*HEADER    ELECTRON TRANSPORT                      26-MAR-18   5ZKV              
*TITLE     SOLUTION STRUCTURE OF MOLTEN GLOBULE STATE OF L94G MUTANT OF HORSE    
*TITLE    2 CYTOCHROME-C                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYTOCHROME C;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS;                                 
*SOURCE   3 ORGANISM_COMMON: HORSE;                                              
*SOURCE   4 ORGANISM_TAXID: 9796;                                                
*SOURCE   5 GENE: CYCS, CYC;                                                     
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_VARIANT: BL21(DE3)                                 
*KEYWDS    STRUCTURE FROM MOLMOL, ELECTRON TRANSPORT                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    15                                                                    
*AUTHOR    A.NAIYER,A.ISLAM,M.I.HASSAN,M.SUNDD,F.AHMAD                           
*REVDAT   1   22-MAY-19 5ZKV    0                                                
# Restraints file 1: Restraints.tbl.V11
!NOE distance restraints, those commented out were not used in minimization.
assign ( resid 1 and name HA1 )( resid 2 and name HA ) 3.4 2.2 2.2
assign ( resid 1 and name HA1 )( resid 96 and name HB ) 3.6 2.2 2.4
assign ( resid 1 and name HA1 )( resid 1 and name HA2 ) 2.4 2.2 0.7
assign ( resid 1 and name HA2 )( resid 2 and name HA ) 3.4 2.2 2.2
assign ( resid 1 and name HA2 )( resid 96 and name HB ) 3.2 2.2 1.5
assign ( resid 2 and name HA )( resid 5 and name HE# ) 3.4 2.2 2.2
assign ( resid 2 and name HB# )( resid 2 and name HA ) 2.9 2.2 1.2
assign ( resid 2 and name HB2 )( resid 5 and name HA ) 3.4 2.2 2.2
assign ( resid 2 and name HB2)( resid 5 and name HB# ) 2.9 2.2 1.2
assign ( resid 2 and name HN )( resid 1 and name HA1 ) 2.9 2.2 1.2
assign ( resid 2 and name HN )( resid 1 and name HA2 ) 2.9 2.2 1.2
assign ( resid 2 and name HN )( resid 2 and name HA ) 3.4 2.2 2.2
assign ( resid 2 and name HN )( resid 2 and name HB1 ) 2.9 2.2 1.2
assign ( resid 2 and name HN )( resid 2 and name HB2 ) 2.4 2.2 0.7
!assign ( resid 2 and name HN )( resid 3 and name HN ) 2.9 2.2 1.2
assign ( resid 2 and name HN )( resid 5 and name HB# ) 3.4 2.2 2.2
assign ( resid 3 and name HA )( resid 2 and name HA ) 3.4 2.2 2.2
assign ( resid 3 and name HA )( resid 3 and name HN ) 2.9 2.2 1.2
assign ( resid 3 and name HA )( resid 3 and name HB ) 2.4 2.2 0.7
assign ( resid 3 and name HA )( resid 3 and name HG2# ) 2.6 2.2 1.0
assign ( resid 3 and name HA )( resid 4 and name HN ) 2.9 2.2 1.2
assign ( resid 3 and name HA )( resid 4 and name HA ) 3.4 2.2 2.2
assign ( resid 3 and name HA )( resid 5 and name HN ) 3.6 2.2 2.4
assign ( resid 3 and name HA )( resid 97 and name HA ) 3.6 2.2 2.4
!assign ( resid 3 and name HA )( resid 97 and name HB1 ) 3.7 1.7 1.5 
assign ( resid 3 and name HA )( resid 97 and name HB2 ) 3.4 2.2 2.2
assign ( resid 3 and name HA )( resid 97 and name HE1 ) 3.6 2.2 2.4
assign ( resid 3 and name HB )( resid 2 and name HA ) 3.6 2.2 2.4
assign ( resid 3 and name HB )( resid 2 and name HB# ) 3.4 2.2 2.2
assign ( resid 3 and name HB )( resid 3 and name HG2# ) 2.6 2.2 1.0
assign ( resid 3 and name HG1# )( resid 3 and name HA ) 3.6 2.2 2.4
assign ( resid 3 and name HG1# )( resid 3 and name HB ) 2.9 2.2 1.2
assign ( resid 3 and name HG1# )( resid 3 and name HG2# ) 3.6 2.2 2.4
assign ( resid 3 and name HG1# )( resid 4 and name HN ) 3.6 2.2 2.4
assign ( resid 3 and name HG1# )( resid 4 and name HA ) 3.6 2.2 2.4
assign ( resid 3 and name HG1# )( resid 97 and name HB1 ) 3.6 2.2 2.4
assign ( resid 3 and name HG1# )( resid 97 and name HD2 ) 3.6 2.2 2.4
assign ( resid 3 and name HG2# )( resid 97 and name HD2 ) 3.6 2.2 2.4
assign ( resid 3 and name HG2# )( resid 100 and name HD# ) 3.6 2.2 2.4
assign ( resid 3 and name HN )( resid 2 and name HA ) 2.4 2.2 0.7
assign ( resid 3 and name HN )( resid 2 and name HB1 ) 2.9 2.2 1.2
assign ( resid 3 and name HN )( resid 2 and name HB2 ) 3.6 2.2 2.4
assign ( resid 3 and name HN )( resid 3 and name HB ) 2.4 2.2 0.7
assign ( resid 3 and name HN )( resid 3 and name HG1# ) 3.2 2.2 1.5
assign ( resid 3 and name HN )( resid 3 and name HG2# ) 3.6 2.2 2.4
assign ( resid 3 and name HN )( resid 4 and name HN ) 2.9 2.2 1.2
assign ( resid 3 and name HN )( resid 4 and name HA ) 3.6 2.2 2.4
assign ( resid 3 and name HN )( resid 5 and name HB# ) 3.6 2.2 2.4
assign ( resid 4 and name HA )( resid 3 and name HG1# ) 3.6 2.2 2.4
assign ( resid 4 and name HA )( resid 4 and name HB# ) 2.4 2.2 0.7
assign ( resid 4 and name HA )( resid 4 and name HG# ) 2.9 2.2 1.2
assign ( resid 4 and name HB# )( resid 3 and name HA ) 3.6 2.2 2.4
assign ( resid 4 and name HB# )( resid 4 and name HG# ) 3.6 2.2 2.4
assign ( resid 4 and name HB# )( resid 3 and name HA ) 3.6 2.2 2.4
assign ( resid 4 and name HB# )( resid 5 and name HN ) 3.4 2.2 2.2
assign ( resid 4 and name HG# )( resid 4 and name HA ) 3.6 2.2 2.4
assign ( resid 4 and name HG# )( resid 4 and name HB# ) 3.6 2.2 2.4
assign ( resid 4 and name HN )( resid 2 and name HA ) 3.6 2.2 2.4
assign ( resid 4 and name HN )( resid 3 and name HG2# ) 3.6 2.2 2.4
assign ( resid 4 and name HN )( resid 4 and name HA ) 2.6 2.2 1.0
assign ( resid 4 and name HN )( resid 4 and name HB# ) 2.6 2.2 1.0
assign ( resid 4 and name HN )( resid 4 and name HG# ) 3.2 2.2 1.5
assign ( resid 4 and name HN )( resid 5 and name HB# ) 3.4 2.2 2.2
assign ( resid 5 and name HB# )( resid 5 and name HA ) 2.9 2.2 1.2
assign ( resid 5 and name HB# )( resid 6 and name HA2 ) 3.6 2.2 2.4
assign ( resid 5 and name HB# )( resid 5 and name HA ) 2.9 2.2 1.2
assign ( resid 5 and name HE# )( resid 5 and name HB# ) 3.6 2.2 2.4
assign ( resid 5 and name HE# )( resid 5 and name HN ) 3.4 2.2 2.2
assign ( resid 5 and name HG# )( resid 5 and name HA ) 3.4 2.2 2.2
assign ( resid 5 and name HG# )( resid 5 and name HB# ) 3.4 2.2 2.2
assign ( resid 5 and name HG# )( resid 4 and name HA ) 3.6 2.2 2.4
assign ( resid 5 and name HG# )( resid 5 and name HN ) 3.4 2.2 2.2
assign ( resid 5 and name HG# )( resid 5 and name HB# ) 3.4 2.2 2.2
assign ( resid 5 and name HN )( resid 2 and name HA ) 3.6 2.2 2.4
assign ( resid 5 and name HN )( resid 2 and name HB1) 2.9 2.2 1.2
assign ( resid 5 and name HN )( resid 2 and name HB2) 2.9 2.2 1.2
assign ( resid 5 and name HN )( resid 4 and name HB# ) 3.6 2.2 2.4
assign ( resid 5 and name HN )( resid 4 and name HG# ) 3.4 2.2 2.2
assign ( resid 5 and name HN )( resid 5 and name HA ) 2.6 2.2 1.0
assign ( resid 5 and name HN )( resid 5 and name HB# ) 3.4 2.2 2.2
assign ( resid 5 and name HN )( resid 5 and name HD# ) 3.4 2.2 2.2
assign ( resid 5 and name HN )( resid 6 and name HA2 ) 3.6 2.2 2.4
assign ( resid 5 and name HN )( resid 7 and name HB# ) 3.6 2.2 2.4
assign ( resid 6 and name HA1 )( resid 5 and name HA ) 3.6 2.2 2.4
assign ( resid 6 and name HA1 )( resid 9 and name HB ) 3.6 1.8 1.6
assign ( resid 6 and name HA2 )( resid 6 and name HA1 ) 3.4 2.2 2.2
assign ( resid 6 and name HA2 )( resid 9 and name HD1# ) 3.2 2.2 1.5
assign ( resid 6 and name HA2 )( resid 9 and name HG1# ) 3.4 2.2 2.2
assign ( resid 6 and name HA2 )( resid 9 and name HG2# ) 3.6 2.2 2.4
assign ( resid 6 and name HN )( resid 2 and name HB# ) 3.6 2.2 2.4
assign ( resid 6 and name HN )( resid 3 and name HB ) 3.6 2.2 2.4
assign ( resid 6 and name HN )( resid 4 and name HB# ) 3.6 2.2 2.4
assign ( resid 6 and name HN )( resid 5 and name HN ) 2.9 2.2 1.2
assign ( resid 6 and name HN )( resid 5 and name HA ) 2.9 2.2 1.2
assign ( resid 6 and name HN )( resid 5 and name HB# ) 2.9 2.2 1.2
assign ( resid 6 and name HN )( resid 6 and name HA1 ) 2.4 2.2 0.7
assign ( resid 6 and name HN )( resid 6 and name HA2 ) 2.9 2.2 1.2
assign ( resid 6 and name HN )( resid 8 and name HN ) 3.4 2.2 2.2
assign ( resid 6 and name HN )( resid 9 and name HD1# ) 3.6 2.2 2.4
assign ( resid 7 and name HA )( resid 10 and name HN ) 2.9 2.2 1.2
!assign ( resid 7 and name HA )( resid 11 and name HG1# ) 3.6 2.2 2.4
assign ( resid 7 and name HA )( resid 6 and name HA1 ) 2.9 2.2 1.2
assign ( resid 7 and name HA )( resid 7 and name HG# ) 2.9 2.2 1.2
assign ( resid 7 and name HA )( resid 7 and name HD# ) 3.4 2.2 2.2
assign ( resid 7 and name HB# )( resid 7 and name HA ) 2.9 2.2 1.2
assign ( resid 7 and name HB# )( resid 7 and name HD# ) 3.4 2.2 2.2
assign ( resid 7 and name HG# )( resid 11 and name HN ) 3.6 2.2 2.4
assign ( resid 7 and name HN )( resid 4 and name HA ) 3.4 2.2 2.2
assign ( resid 7 and name HN )( resid 5 and name HA ) 3.6 2.2 2.4
!assign ( resid 7 and name HN )( resid 5 and name HB# ) 3.6 2.2 2.4
assign ( resid 7 and name HN )( resid 6 and name HN ) 2.4 2.2 0.7
assign ( resid 7 and name HN )( resid 6 and name HA1 ) 2.4 2.2 0.7
assign ( resid 7 and name HN )( resid 6 and name HA2 ) 2.9 2.2 1.2
assign ( resid 7 and name HN )( resid 7 and name HA ) 2.4 2.2 0.7
assign ( resid 7 and name HN )( resid 7 and name HB# ) 2.4 2.2 0.7
assign ( resid 7 and name HN )( resid 7 and name HD# ) 3.4 2.2 2.2
assign ( resid 7 and name HN )( resid 7 and name HG# ) 3.6 2.2 2.4
assign ( resid 7 and name HN )( resid 8 and name HN ) 2.4 2.2 0.7
assign ( resid 7 and name HN )( resid 8 and name HB ) 3.4 2.2 2.2
!assign ( resid 7 and name HN )( resid 9 and name HA ) 3.6 2.2 2.4
assign ( resid 7 and name HN )( resid 97 and name HB2 ) 3.4 2.2 2.2
assign ( resid 7 and name HN )( resid 97 and name HD2 ) 3.6 2.2 2.4
assign ( resid 8 and name HA )( resid 8 and name HB# ) 2.4 2.2 0.7
!assign ( resid 8 and name HA )( resid 8 and name HE2 ) 3.6 2.2 2.4
assign ( resid 8 and name HA )( resid 8 and name HG# ) 3.6 2.2 2.4
assign ( resid 8 and name HA )( resid 9 and name HN ) 2.9 2.2 1.2
assign ( resid 8 and name HA )( resid 12 and name HG# ) 3.6 2.2 2.4
assign ( resid 8 and name HB# )( resid 9 and name HN ) 2.9 2.2 1.2
assign ( resid 8 and name HD# )( resid 8 and name HA ) 3.6 2.2 2.4
assign ( resid 8 and name HD# )( resid 9 and name HD1# ) 3.4 2.2 2.2
assign ( resid 8 and name HD# )( resid 9 and name HG2# ) 3.6 2.2 2.4
assign ( resid 8 and name HG# )( resid 8 and name HB# ) 3.2 2.2 1.5
assign ( resid 8 and name HG# )( resid 8 and name HD# ) 3.6 2.2 2.4
assign ( resid 8 and name HN )( resid 7 and name HA ) 2.9 2.2 1.2
assign ( resid 8 and name HN )( resid 7 and name HD# ) 3.4 2.2 2.2
assign ( resid 8 and name HN )( resid 7 and name HE# ) 3.4 2.2 2.2
assign ( resid 8 and name HN )( resid 8 and name HA ) 2.4 2.2 0.7
assign ( resid 8 and name HN )( resid 8 and name HB# ) 2.4 2.2 0.7
assign ( resid 8 and name HN )( resid 8 and name HD# ) 3.4 2.2 2.2
assign ( resid 8 and name HN )( resid 8 and name HG# ) 3.4 2.2 2.2
assign ( resid 8 and name HN )( resid 9 and name HN ) 2.9 2.2 1.2
assign ( resid 8 and name HN )( resid 11 and name HN ) 3.4 2.2 2.2
!assign ( resid 8 and name HN )( resid 11 and name HG1# ) 3.6 2.2 2.4
!assign ( resid 8 and name HN )( resid 11 and name HG2# ) 3.6 2.2 2.4
assign ( resid 9 and name HA )( resid 10 and name HN ) 3.4 2.2 2.2
assign ( resid 9 and name HA )( resid 12 and name HN ) 2.9 2.2 1.2
assign ( resid 9 and name HA )( resid 9 and name HN ) 2.9 2.2 1.2
assign ( resid 9 and name HA )( resid 9 and name HB ) 2.9 2.2 1.2
assign ( resid 9 and name HA )( resid 9 and name HD1# ) 3.2 2.2 1.5
assign ( resid 9 and name HA )( resid 9 and name HG12 ) 2.9 2.2 1.2
assign ( resid 9 and name HA )( resid 9 and name HG2# ) 2.6 2.2 1.0
assign ( resid 9 and name HB )( resid 10 and name HA ) 3.4 2.2 2.2
assign ( resid 9 and name HB )( resid 10 and name HN ) 2.4 2.2 0.7
assign ( resid 9 and name HB )( resid 9 and name HG2# ) 3.2 2.2 1.5
assign ( resid 9 and name HD1# )( resid 85 and name HD1 ) 3.9 2.2 2.2
assign ( resid 9 and name HD1# )( resid 9 and name HB ) 3.2 2.2 1.5
assign ( resid 9 and name HD1# )( resid 9 and name HG2# ) 3.4 2.2 2.2
assign ( resid 9 and name HG1# )( resid 9 and name HD1# ) 3.4 2.2 2.2
assign ( resid 9 and name HG12 )( resid 9 and name HG2# ) 3.6 2.2 2.4
assign ( resid 9 and name HG2# )( resid 12 and name HN ) 3.6 2.2 2.4
assign ( resid 9 and name HN )( resid 10 and name HN ) 2.9 2.2 1.2
assign ( resid 9 and name HN )( resid 10 and name HB1 ) 3.4 2.2 2.2
assign ( resid 9 and name HN )( resid 6 and name HA2 ) 3.4 2.2 2.2
assign ( resid 9 and name HN )( resid 7 and name HN ) 3.4 2.2 2.2
assign ( resid 9 and name HN )( resid 8 and name HA ) 2.9 2.2 1.2
assign ( resid 9 and name HN )( resid 8 and name HB# ) 2.9 2.2 1.2
assign ( resid 9 and name HN )( resid 8 and name HG# ) 3.2 2.2 1.5
assign ( resid 9 and name HN )( resid 9 and name HB ) 2.6 2.2 1.0
assign ( resid 9 and name HN )( resid 9 and name HD1# ) 3.2 2.2 1.5
assign ( resid 9 and name HN )( resid 9 and name HG12 ) 2.9 2.2 1.2
assign ( resid 9 and name HN )( resid 9 and name HG2# ) 3.6 2.2 2.4
assign ( resid 10 and name HA )( resid 10 and name HB1 ) 2.9 2.2 1.2
assign ( resid 10 and name HA )( resid 10 and name HB2 ) 2.9 2.2 1.2
assign ( resid 10 and name HA )( resid 10 and name HD2 ) 2.9 2.2 1.2
assign ( resid 10 and name HA )( resid 11 and name HN ) 2.9 2.2 1.2
assign ( resid 10 and name HA )( resid 9 and name HA ) 3.6 2.2 2.4
assign ( resid 10 and name HA )( resid 15 and name HB# ) 3.6 2.2 2.4
assign ( resid 10 and name HB1 )( resid 10 and name HD1 ) 3.4 2.2 2.2
assign ( resid 10 and name HB1 )( resid 10 and name HD2 ) 3.9 2.2 2.2
assign ( resid 10 and name HB1 )( resid 7 and name HA ) 3.5 1.5 1.5
assign ( resid 10 and name HB2 )( resid 10 and name HD1 ) 3.9 2.2 2.2
assign ( resid 10 and name HB2 )( resid 10 and name HD2 ) 2.9 2.2 1.2
assign ( resid 10 and name HD1 )( resid 15 and name HA ) 3.4 2.2 2.2
assign ( resid 10 and name HD1 )( resid 15 and name HB# ) 3.6 2.2 2.4
assign ( resid 10 and name HE2 )( resid 20 and name HG2# ) 3.6 2.2 2.4
assign ( resid 10 and name HN )( resid 10 and name HA ) 2.9 2.2 1.2
assign ( resid 10 and name HN )( resid 10 and name HB1 ) 2.9 2.2 1.2
assign ( resid 10 and name HN )( resid 10 and name HB2 ) 2.4 2.2 0.7
assign ( resid 10 and name HN )( resid 10 and name HD1 ) 3.4 2.2 2.2
assign ( resid 10 and name HN )( resid 11 and name HN ) 2.9 2.2 1.2
assign ( resid 10 and name HN )( resid 8 and name HN ) 3.2 2.2 1.5
assign ( resid 10 and name HN )( resid 9 and name HB ) 2.9 2.2 1.2
assign ( resid 10 and name HN )( resid 9 and name HD1# ) 3.4 2.2 2.2
assign ( resid 11 and name HA )( resid 10 and name HD2 ) 3.9 2.2 2.2 
assign ( resid 11 and name HA )( resid 12 and name HG# ) 3.6 2.2 2.4
assign ( resid 11 and name HA )( resid 14 and name HG# ) 3.4 2.2 2.2
assign ( resid 11 and name HB )( resid 11 and name HA ) 3.6 2.2 2.4
!assign ( resid 11 and name HG1# )( resid 10 and name HA ) 3.6 2.2 2.4
assign ( resid 11 and name HG1# )( resid 11 and name HA ) 2.6 2.2 1.0
assign ( resid 11 and name HG1# )( resid 11 and name HB ) 2.6 2.2 1.0
assign ( resid 11 and name HG1# )( resid 11 and name HG2# ) 2.9 2.2 1.2
assign ( resid 11 and name HG1# )( resid 12 and name HA ) 3.2 2.2 1.5
assign ( resid 11 and name HG1# )( resid 12 and name HB2 ) 3.6 2.2 2.4
assign ( resid 11 and name HG1# )( resid 12 and name HG# ) 3.6 2.2 2.4
assign ( resid 11 and name HG1# )( resid 12 and name HN ) 3.6 2.2 2.4
!assign ( resid 11 and name HG2# )( resid 8 and name HA ) 2.6 2.2 1.0
assign ( resid 11 and name HG2# )( resid 8 and name HB# ) 3.4 2.2 2.2
assign ( resid 11 and name HG2# )( resid 11 and name HA ) 3.2 2.2 1.5
assign ( resid 11 and name HG2# )( resid 11 and name HB ) 2.6 2.2 1.0
assign ( resid 11 and name HN )( resid 7 and name HA ) 3.4 2.2 2.2
assign ( resid 11 and name HN )( resid 8 and name HA ) 3.4 2.2 2.2
assign ( resid 11 and name HN )( resid 8 and name HB1 ) 3.6 2.2 2.4
assign ( resid 11 and name HN )( resid 10 and name HA ) 2.9 2.2 1.2
assign ( resid 11 and name HN )( resid 10 and name HB1 ) 2.9 2.2 1.2
assign ( resid 11 and name HN )( resid 10 and name HB2 ) 2.9 2.2 1.2
assign ( resid 11 and name HN )( resid 10 and name HD1 ) 3.4 2.2 2.2
assign ( resid 11 and name HN )( resid 10 and name HD2 ) 3.4 2.2 2.2
assign ( resid 11 and name HN )( resid 11 and name HA ) 2.9 2.2 1.2
assign ( resid 11 and name HN )( resid 11 and name HB ) 2.9 2.2 1.2
assign ( resid 11 and name HN )( resid 11 and name HG1# ) 3.2 2.2 1.5
assign ( resid 11 and name HN )( resid 11 and name HG2# ) 3.2 2.2 1.5
assign ( resid 11 and name HN )( resid 12 and name HN ) 2.9 2.2 1.2
assign ( resid 11 and name HN )( resid 12 and name HG# ) 3.6 2.2 2.4
assign ( resid 11 and name HN )( resid 15 and name HB# ) 3.6 2.2 2.4
!assign ( resid 12 and name HA )( resid 11 and name HA ) 3.2 2.2 1.5
assign ( resid 12 and name HA )( resid 12 and name HB# ) 2.9 2.2 1.2
assign ( resid 12 and name HA )( resid 12 and name HG1# ) 2.9 2.2 1.2
assign ( resid 12 and name HA )( resid 12 and name HG2# ) 2.9 2.2 1.2
assign ( resid 12 and name HB# )( resid 9 and name HA ) 3.4 2.2 2.2
assign ( resid 12 and name HG1 )( resid 9 and name HA ) 2.9 2.2 1.2
assign ( resid 12 and name HG1 )( resid 11 and name HN ) 3.6 2.2 2.4
assign ( resid 12 and name HG1 )( resid 12 and name HB# ) 2.4 2.2 0.7
assign ( resid 12 and name HG2 )( resid 12 and name HB# ) 2.9 2.2 1.2
assign ( resid 12 and name HG2 )( resid 8 and name HG# ) 3.4 2.2 2.2
assign ( resid 12 and name HN )( resid 9 and name HA ) 2.9 2.2 1.2
assign ( resid 12 and name HN )( resid 11 and name HB ) 2.9 2.2 1.2
assign ( resid 12 and name HN )( resid 11 and name HG1# ) 3.2 2.2 1.5
assign ( resid 12 and name HN )( resid 11 and name HG2# ) 3.2 2.2 1.5
assign ( resid 12 and name HN )( resid 12 and name HA ) 2.9 2.2 1.2
assign ( resid 12 and name HN )( resid 12 and name HB# ) 2.9 2.2 1.2
assign ( resid 12 and name HN )( resid 12 and name HG1 ) 2.9 2.2 1.2
assign ( resid 12 and name HN )( resid 12 and name HG2 ) 2.9 2.2 1.2
assign ( resid 12 and name HN )( resid 15 and name HB# ) 3.6 2.2 2.4
assign ( resid 13 and name HA )( resid 13 and name HB# ) 2.4 2.2 0.7
assign ( resid 13 and name HA )( resid 14 and name HN ) 2.9 2.2 1.2
assign ( resid 13 and name HA )( resid 13 and name HE# ) 3.4 2.2 2.2
assign ( resid 13 and name HA )( resid 82 and name HD# ) 3.6 2.2 2.4
assign ( resid 13 and name HA )( resid 82 and name HE# ) 3.6 2.2 2.4
assign ( resid 13 and name HA )( resid 85 and name HG1# ) 3.6 2.2 2.4
assign ( resid 13 and name HB# )( resid 13 and name HE# ) 3.4 2.2 2.2
assign ( resid 13 and name HB# )( resid 9 and name HG2# ) 2.9 2.2 1.2 
assign ( resid 13 and name HB# )( resid 14 and name HN ) 3.4 2.2 2.2
assign ( resid 13 and name HB# )( resid 85 and name HD1# ) 3.6 2.2 2.4
assign ( resid 13 and name HD2 )( resid 13 and name HB# ) 3.4 2.2 2.2
assign ( resid 13 and name HN)( (resid 9 and name HG2# ) 3.6 2.2 2.4
assign ( resid 13 and name HN )( resid 10 and name HA ) 3.4 2.2 2.2
assign ( resid 13 and name HN )( resid 11 and name HA ) 3.4 2.2 2.2
assign ( resid 13 and name HN )( resid 12 and name HN ) 2.4 2.2 0.7
assign ( resid 13 and name HN )( resid 12 and name HA ) 2.9 2.2 1.2
assign ( resid 13 and name HN )( resid 12 and name HB# ) 2.9 2.2 1.2
assign ( resid 13 and name HN )( resid 12 and name HG# ) 3.4 2.2 2.2
assign ( resid 13 and name HN )( resid 13 and name HA ) 2.9 2.2 1.2
assign ( resid 13 and name HN )( resid 13 and name HB# ) 2.9 2.2 1.2
assign ( resid 13 and name HN )( resid 14 and name HN ) 2.4 2.2 0.7
assign ( resid 13 and name HN )( resid 15 and name HN ) 3.2 2.2 1.5
assign ( resid 13 and name HN )( resid 15 and name HB# ) 3.6 2.2 2.4
!assign ( resid 14 and name HA )( resid 10 and name HA ) 3.2 2.2 1.5
assign ( resid 14 and name HA )( resid 14 and name HB2 ) 2.9 2.2 1.2
assign ( resid 14 and name HA )( resid 16 and name HN ) 3.4 2.2 2.2
assign ( resid 14 and name HB1 )( resid 14 and name HB2 ) 2.9 2.2 1.2
assign ( resid 14 and name HN )( resid 10 and name HA ) 2.9 2.2 1.2
assign ( resid 14 and name HN )( resid 14 and name HA ) 2.4 2.2 0.7
assign ( resid 14 and name HN )( resid 14 and name HB2 ) 2.9 2.2 1.2
assign ( resid 14 and name HN )( resid 15 and name HB# ) 3.6 2.2 2.4
assign ( resid 15 and name HA )( resid 10 and name HD1 ) 3.4 2.2 2.2
assign ( resid 15 and name HA )( resid 10 and name HE1 ) 3.4 2.2 2.2
assign ( resid 15 and name HA )( resid 10 and name HE2 ) 3.4 2.2 2.2
assign (resid  15 and name HA) ( resid 10 and name HZ)  3.4 2.2 2.2
assign ( resid 15 and name HA )( resid 14 and name HA ) 3.6 2.2 2.4
assign ( resid 15 and name HA )( resid 14 and name HN ) 3.4 2.2 2.2
assign ( resid 15 and name HA )( resid 15 and name HB# ) 2.6 2.2 1.0
assign ( resid 15 and name HA )( resid 15 and name HN ) 2.9 2.2 1.2
assign ( resid 15 and name HB# )( resid 10 and name HE1 ) 3.6 2.2 2.4
assign ( resid 15 and name HB# )( resid 10 and name HD1 ) 3.6 2.2 2.4
assign ( resid 15 and name HB# )( resid 11 and name HA ) 2.6 2.2 1.0
assign ( resid 15 and name HB# )( resid 11 and name HG1# ) 3.9 2.2 2.2
assign ( resid 15 and name HB# )( resid 18 and name HN ) 3.6 2.2 2.4
assign (resid  15 and name HN) ( resid 11 and name HA) 2.9 2.2 1.2
assign ( resid 15 and name HN )( resid 10 and name HE2 ) 3.4 2.2 2.2
assign ( resid 15 and name HN )( resid 12 and name HN ) 3.4 2.2 2.2
assign ( resid 15 and name HN )( resid 14 and name HA ) 3.4 2.2 2.2
assign ( resid 15 and name HN )( resid 14 and name HB2 ) 3.4 2.2 2.2
assign ( resid 15 and name HN )( resid 15 and name HA ) 2.9 2.2 1.2
assign ( resid 15 and name HN )( resid 15 and name HB# ) 2.6 2.2 1.0
assign ( resid 15 and name HN )( resid 16 and name HG1 ) 3.4 2.2 2.2
assign ( resid 16 and name HA )( resid 15 and name HB# ) 3.6 2.2 2.4
assign ( resid 16 and name HA )( resid 16 and name HB1 ) 2.4 2.2 0.7
assign ( resid 16 and name HA )( resid 16 and name HG1 ) 2.9 2.2 1.2
assign ( resid 16 and name HA )( resid 16 and name HG2 ) 2.9 2.2 1.2
assign ( resid 16 and name HB1 )( resid 16 and name HG1 ) 3.6 2.2 2.4
assign ( resid 16 and name HB1 )( resid 18 and name HN ) 3.4 2.2 2.2
assign ( resid 16 and name HB2 )( resid 16 and name HA ) 2.4 2.2 0.7
assign ( resid 16 and name HB2 )( resid 16 and name HB1 ) 2.4 2.2 0.7
assign ( resid 16 and name HB2 )( resid 16 and name HG2 ) 3.6 2.2 2.4
assign ( resid 16 and name HG1 )( resid 15 and name HB# ) 3.6 2.2 2.4
assign ( resid 16 and name HN )( resid 15 and name HA ) 2.9 2.2 1.2
assign ( resid 16 and name HN )( resid 15 and name HN ) 2.9 2.2 1.2
assign ( resid 16 and name HN )( resid 15 and name HB# ) 3.6 2.2 2.4
assign ( resid 16 and name HN )( resid 16 and name HA ) 2.4 2.2 0.7
assign ( resid 16 and name HN )( resid 16 and name HB1 ) 2.9 2.2 1.2
assign ( resid 16 and name HN )( resid 16 and name HB2 ) 2.9 2.2 1.2
assign ( resid 16 and name HN )( resid 16 and name HG1 ) 3.4 2.2 2.2
assign ( resid 16 and name HN )( resid 16 and name HG2 ) 2.9 2.2 1.2
assign ( resid 16 and name HN )( resid 17 and name HN ) 2.9 2.2 1.2
assign ( resid 17 and name HA )( resid 16 and name HA ) 3.4 2.2 2.2
assign (resid  17 and name HA) (resid  16 and name HG#) 3.6 2.2 2.4
assign ( resid 17 and name HA )( resid 17 and name HB1 ) 3.2 2.2 1.5
assign ( resid 17 and name HA )( resid 17 and name HB2 ) 3.2 2.2 1.5
assign ( resid 17 and name HA )( resid 18 and name HN ) 2.9 2.2 1.2
assign ( resid 17 and name HA )( resid 28 and name HA ) 3.4 2.2 2.2
assign ( resid 17 and name HA )( resid 28 and name HB ) 2.9 2.2 1.2
assign ( resid 17 and name HA )( resid 29 and name HN ) 3.4 2.2 2.2
assign ( resid 17 and name HB2 )( resid 17 and name HB1 ) 3.4 2.2 2.2
assign ( resid 17 and name HN )( resid 16 and name HB1 ) 2.9 2.2 1.2
assign ( resid 17 and name HN )( resid 16 and name HB2 ) 3.4 2.2 2.2
assign ( resid 17 and name HN )( resid 16 and name HG# ) 3.4 2.2 2.2
assign ( resid 17 and name HN )( resid 17 and name HA ) 2.9 2.2 1.2
assign ( resid 17 and name HN )( resid 17 and name HB1 ) 2.9 2.2 1.2
assign ( resid 17 and name HN )( resid 17 and name HB2 ) 2.9 2.2 1.2
!assign ( resid 17 and name HN )( resid 18 and name HA ) 2.9 2.2 1.2
assign ( resid 18 and name HN )( resid 15 and name HA ) 2.9 2.2 1.2
assign ( resid 18 and name HN )( resid 16 and name HN ) 3.4 2.2 2.2
assign ( resid 18 and name HN )( resid 17 and name HN ) 2.9 2.2 1.2
assign ( resid 19 and name HA )( resid 18 and name HN ) 3.4 2.2 2.2
assign ( resid 19 and name HA )( resid 19 and name HB ) 2.4 2.2 0.7
assign ( resid 19 and name HA )( resid 19 and name HG2# ) 2.6 2.2 1.0 
assign ( resid 19 and name HB )( resid 19 and name HG2# ) 2.6 2.2 1.0 
assign ( resid 19 and name HB )( resid 20 and name HG2# ) 3.6 2.2 2.4 
assign ( resid 19 and name HB )( resid 25 and name HN ) 3.4 2.2 2.2
assign ( resid 19 and name HG2# )( resid 25 and name HN ) 3.2 2.2 1.5
assign ( resid 19 and name HG2# )( resid 20 and name HN ) 3.6 2.2 2.4
assign ( resid 19 and name HG2# )( resid 26 and name HN ) 3.6 2.2 2.4
assign ( resid 19 and name HN )( resid 18 and name HN ) 3.4 2.2 2.2
assign ( resid 19 and name HN )( resid 18 and name HA ) 3.4 2.2 2.2
assign ( resid 19 and name HN )( resid 18 and name HD2 ) 3.4 2.2 2.2
assign ( resid 19 and name HN )( resid 19 and name HA ) 3.4 2.2 2.2
assign ( resid 19 and name HN )( resid 19 and name HB ) 3.4 2.2 2.2
assign ( resid 19 and name HN )( resid 19 and name HG2# ) 3.6 2.2 2.4
assign ( resid 20 and name HA )( resid 19 and name HA ) 3.6 2.2 2.4
assign ( resid 20 and name HA )( resid 20 and name HB ) 2.4 2.2 0.7
assign ( resid 20 and name HA )( resid 20 and name HG1# ) 3.2 2.2 1.5
assign ( resid 20 and name HA )( resid 20 and name HG2# ) 2.6 2.2 1.0
assign ( resid 20 and name HB )( resid 20 and name HG1# ) 2.6 2.2 1.0
assign ( resid 20 and name HB )( resid 20 and name HG2# ) 2.6 2.2 1.0
!assign ( resid 20 and name HG1# )( resid 10 and name HD2 ) 3.6 2.2 2.4
!assign ( resid 20 and name HG1# )( resid 32 and name HB2 ) 3.4 2.2 2.2
assign ( resid 20 and name HG2# )( resid 10 and name HE2 ) 3.6 2.2 2.4
assign ( resid 20 and name HG2# )( resid 20 and name HG1# ) 3.6 2.2 2.4
assign ( resid 20 and name HN )( resid 19 and name HN ) 3.2 2.2 1.2
assign ( resid 20 and name HN )( resid 19 and name HA ) 2.9 2.2 1.2
assign ( resid 20 and name HN )( resid 19 and name HB ) 2.9 2.2 1.2
assign ( resid 20 and name HN )( resid 20 and name HB ) 2.9 2.2 1.2
assign ( resid 20 and name HN )( resid 20 and name HG1# ) 3.6 2.2 2.4
assign ( resid 20 and name HN )( resid 20 and name HG2# ) 3.6 2.2 2.4
assign ( resid 21 and name HA )( resid 21 and name HB# ) 2.9 2.2 1.2
assign ( resid 21 and name HA )( resid 21 and name HG# ) 2.9 2.2 1.2
assign ( resid 21 and name HA )( resid 22 and name HN ) 2.4 2.2 0.7
assign ( resid 21 and name HB )( resid 21 and name HG# ) 2.9 2.2 1.2
assign ( resid 21 and name HB )( resid 22 and name HN ) 2.9 2.2 1.2
assign ( resid 21 and name HB )( resid 24 and name HN ) 3.4 2.2 2.2
!assign ( resid 21 and name HN )( resid 19 and name HB# ) 2.9 2.2 1.2
assign ( resid 21 and name HN )( resid 19 and name HG2# ) 3.6 2.2 2.4
assign ( resid 21 and name HN )( resid 21 and name HA ) 2.9 2.2 1.2
assign ( resid 21 and name HN )( resid 21 and name HB# ) 3.4 2.2 2.2
assign ( resid 21 and name HN )( resid 21 and name HG# ) 2.9 2.2 1.2
assign ( resid 21 and name HN )( resid 22 and name HN ) 3.4 2.2 2.2
assign ( resid 22 and name HA )( resid 22 and name HB# ) 3.4 2.2 2.2
assign ( resid 22 and name HA )( resid 22 and name HD# ) 2.9 2.2 1.2
assign ( resid 22 and name HA )( resid 23 and name HA1 ) 3.4 2.2 2.2
assign ( resid 22 and name HN )( resid 22 and name HA ) 2.9 2.2 1.2
assign ( resid 22 and name HN )( resid 22 and name HB# ) 2.9 2.2 1.2
assign ( resid 22 and name HN )( resid 22 and name HG# ) 3.4 2.2 2.2
assign ( resid 22 and name HN )( resid 24 and name HN ) 3.4 2.2 2.2
assign ( resid 23 and name HA1 )( resid 23 and name HA2 ) 2.4 2.2 0.7
assign ( resid 23 and name HN )( resid 22 and name HA ) 2.9 2.2 1.2
assign ( resid 23 and name HN )( resid 22 and name HB# ) 3.4 2.2 2.2
assign ( resid 23 and name HN )( resid 22 and name HD# ) 3.4 2.2 2.2
assign ( resid 23 and name HN )( resid 22 and name HG# ) 3.4 2.2 2.2
assign ( resid 23 and name HN )( resid 23 and name HA1 ) 2.9 2.2 1.2
assign ( resid 23 and name HN )( resid 23 and name HA2 ) 3.4 2.2 2.2
assign ( resid 23 and name HN )( resid 24 and name HN ) 2.9 2.2 1.2
!assign ( resid 24 and name HA1 )( resid 19 and name HG2# ) 3.6 2.2 2.4
assign ( resid 24 and name HA1 )( resid 24 and name HA2 ) 2.4 2.2 0.7
!assign ( resid 24 and name HA1 )( resid 31 and name HB1 ) 3.5 1.5 2.0
assign ( resid 24 and name HA2 )( resid 19 and name HG2# ) 3.6 2.2 2.4
assign ( resid 24 and name HN )( resid 19 and name HG2# ) 3.6 2.2 2.4
assign ( resid 24 and name HN )( resid 24 and name HA1 ) 2.4 2.2 0.7
assign ( resid 25 and name HA )( resid 26 and name HN ) 2.6 2.2 1.0
assign ( resid 25 and name HA )( resid 25 and name HB# ) 2.9 2.2 1.2
assign ( resid 25 and name HN )( resid 19 and name HB ) 3.4 2.2 2.2
assign ( resid 25 and name HN )( resid 24 and name HA1 ) 2.6 2.2 1.0
assign ( resid 25 and name HN )( resid 24 and name HA2 ) 2.9 2.2 1.2
assign ( resid 25 and name HN )( resid 25 and name HA ) 2.6 2.2 1.0
assign ( resid 25 and name HN )( resid 25 and name HB# ) 2.9 2.2 1.2
assign ( resid 26 and name HA )( resid 26 and name HB1 ) 3.4 2.2 2.2
assign ( resid 26 and name HA )( resid 26 and name HB2 ) 3.4 2.2 2.2
assign ( resid 26 and name HA )( resid 26 and name HD2 ) 3.4 2.2 2.2
!assign ( resid 26 and name HB# )( resid 24 and name HA1 ) 3.6 2.2 2.4
assign ( resid 26 and name HB1 )( resid 26 and name HB2 ) 2.4 2.2 0.7
assign ( resid 26 and name HB1 )( resid 26 and name HD2 ) 3.6 2.2 2.4
assign ( resid 26 and name HB1 )( resid 27 and name HN ) 2.9 2.2 1.2
assign ( resid 26 and name HB1 )( resid 46 and name HB1 ) 3.6 2.2 2.4
assign ( resid 26 and name HB2 )( resid 26 and name HD2 ) 3.6 2.2 2.4
assign ( resid 26 and name HB2 )( resid 27 and name HN ) 2.9 2.2 1.2
assign ( resid 26 and name HB2 )( resid 46 and name HB1 ) 3.6 2.2 2.4
assign ( resid 26 and name HN )( resid 25 and name HB ) 2.9 2.2 1.2
assign ( resid 26 and name HN )( resid 26 and name HA ) 2.9 2.2 1.2
assign ( resid 26 and name HN )( resid 26 and name HB1 ) 2.9 2.2 1.2
assign ( resid 26 and name HN )( resid 26 and name HB2 ) 3.4 2.2 2.2
assign ( resid 26 and name HN )( resid 27 and name HN ) 3.4 2.2 2.2
assign ( resid 27 and name HA )( resid 26 and name HA ) 3.6 2.2 2.4
assign ( resid 27 and name HA )( resid 27 and name HD# ) 3.6 2.2 2.4
!assign ( resid 27 and name HB# )( resid 27 and name HB# ) 3.6 2.2 2.4
assign ( resid 27 and name HB# )( resid 27 and name HG# ) 3.6 2.2 2.4
assign ( resid 27 and name HN )( resid 19 and name HG2# ) 3.6 2.2 2.4
assign ( resid 27 and name HN )( resid 26 and name HA ) 2.9 2.2 1.2
assign ( resid 27 and name HN )( resid 27 and name HA ) 2.9 2.2 1.2
assign ( resid 27 and name HN )( resid 27 and name HB# ) 2.9 2.2 1.2
assign ( resid 27 and name HN )( resid 27 and name HD# ) 3.4 2.2 2.2
assign ( resid 27 and name HN )( resid 27 and name HG# ) 3.4 2.2 2.2
assign ( resid 28 and name HA )( resid 28 and name HG2# )2.6 2.2 1.0 
!assign ( resid 28 and name HB )( resid 16 and name HA )  3.2 2.2 1.5
assign ( resid 28 and name HB )( resid 17 and name HA ) 2.9 2.2 1.2
assign ( resid 28 and name HB )( resid 28 and name HA ) 3.6 2.2 2.4
assign ( resid 28 and name HB )( resid 28 and name HG2# ) 3.2 2.2 1.5
assign ( resid 29 and name HN )( resid 29 and name HA# ) 3.4 2.2 2.2
assign ( resid 30 and name HA )( resid 30 and name HB# ) 2.9 2.2 1.2
assign ( resid 30 and name HA )( resid 30 and name HG# ) 3.6 2.2 2.4
assign ( resid 30 and name HB1 )( resid 30 and name HB2 ) 2.9 2.2 1.2
assign ( resid 30 and name HB# )( resid 29 and name HA# ) 3.6 2.2 2.4
assign ( resid 30 and name HB# )( resid 30 and name HG# ) 3.6 2.2 2.4
assign ( resid 30 and name HD1 )( resid 30 and name HA ) 3.6 2.2 2.4
assign ( resid 30 and name HD2 )( resid 30 and name HA ) 3.6 2.2 2.4
assign ( resid 30 and name HD2 )( resid 30 and name HD1 ) 2.9 2.2 1.2
assign ( resid 30 and name HD2 )( resid 30 and name HG# ) 2.9 2.2 1.2
!assign ( resid 31 and name HA )( resid 19 and name HN ) 3.4 2.2 2.2
assign ( resid 31 and name HA )( resid 30 and name HA ) 3.4 2.2 2.2
assign ( resid 31 and name HA )( resid 31 and name HB1 ) 2.9 2.2 1.2
assign ( resid 31 and name HA )( resid 31 and name HB2 ) 3.2 2.2 1.5
assign ( resid 31 and name HB1 )( resid 30 and name HA ) 3.4 2.2 2.2
assign ( resid 31 and name HB1 )( resid 31 and name HB2 ) 2.4 2.2 0.7
assign ( resid 31 and name HN )( resid 31 and name HA ) 2.9 2.2 1.2
assign ( resid 31 and name HN )( resid 31 and name HB1 ) 2.9 2.2 1.2
assign ( resid 31 and name HN )( resid 31 and name HB2 ) 2.9 2.2 1.2
assign ( resid 31 and name HN )( resid 43 and name HB# ) 3.6 2.2 2.4
assign ( resid 32 and name HA )( resid 31 and name HA ) 3.4 2.2 2.2 
assign ( resid 32 and name HA )( resid 32 and name HB2 ) 3.2 2.2 1.5
assign ( resid 32 and name HA )( resid 32 and name HD1# ) 3.4 2.2 2.2
assign ( resid 32 and name HA )( resid 32 and name HD2# ) 3.2 2.2 1.5
assign ( resid 32 and name HA )( resid 32 and name HG ) 3.4 2.2 2.2 
assign ( resid 32 and name HB1 )( resid 32 and name HN ) 3.4 2.2 2.2 
assign ( resid 32 and name HB1 )( resid 32 and name HA ) 3.4 2.2 2.2 
assign ( resid 32 and name HB1 )( resid 32 and name HD2# ) 3.4 2.2 2.2 
assign ( resid 32 and name HB1 )( resid 32 and name HG ) 3.4 2.2 2.2 
assign ( resid 32 and name HB1 )( resid 33 and name HN ) 3.4 2.2 2.2 
assign ( resid 32 and name HB1 )( resid 35 and name HD2# ) 3.4 2.2 2.2 
assign ( resid 32 and name HB2 )( resid 32 and name HG ) 3.4 2.2 2.2 
assign ( resid 32 and name HD1# )( resid 32 and name HB1 ) 3.4 2.2 2.2 
assign ( resid 32 and name HD2# )( resid 20 and name HZ ) 3.4 2.2 2.2
assign ( resid 32 and name HD2# )( resid 32 and name HB2 ) 3.4 2.2 2.2 
assign ( resid 32 and name HG )( resid 32 and name HD1# ) 3.4 2.2 2.2 
assign ( resid 32 and name HG )( resid 32 and name HD2# ) 3.4 2.2 2.2 
assign ( resid 32 and name HN )( resid 31 and name HA ) 2.9 2.2 1.3
assign ( resid 32 and name HN )( resid 31 and name HB1 ) 3.4 2.2 2.2
assign ( resid 32 and name HN )( resid 31 and name HB2 ) 3.4 2.2 2.2
assign ( resid 32 and name HN )( resid 32 and name HA ) 2.9 2.2 1.2
assign ( resid 32 and name HN )( resid 32 and name HB2 ) 3.4 2.2 2.2
assign ( resid 32 and name HN )( resid 32 and name HD1# ) 3.6 2.2 2.4
assign ( resid 32 and name HN )( resid 32 and name HD2# ) 3.4 2.2 2.2
!assign ( resid 32 and name HN )( resid 32 and name HG ) 2.9 2.2 1.3
!assign ( resid 32 and name HN )( resid 35 and name HD1# ) 3.6 2.2 2.4
assign ( resid 33 and name HA )( resid 32 and name HN ) 3.6 2.2 2.4
assign ( resid 33 and name HA )( resid 32 and name HD2# ) 3.6 2.2 2.4
assign ( resid 33 and name HA )( resid 33 and name HB2 ) 3.4 2.2 2.2
assign ( resid 33 and name HA )( resid 33 and name HD2 ) 3.4 2.2 2.2
assign ( resid 33 and name HB1 )( resid 33 and name HA ) 3.4 2.2 2.2
assign ( resid 33 and name HB1 )( resid 32 and name HD1# ) 3.6 2.2 2.4
assign ( resid 33 and name HB2 )( resid 32 and name HD1# ) 3.6 2.2 2.4
assign ( resid 33 and name HB2 )( resid 32 and name HD2# ) 3.6 2.2 2.4
assign ( resid 33 and name HB2 )( resid 33 and name HB1 ) 2.4 2.2 0.7
assign ( resid 33 and name HN )( resid 32 and name HA ) 3.4 2.2 2.2
assign ( resid 33 and name HN )( resid 32 and name HD1# ) 3.6 2.2 2.4
assign ( resid 33 and name HN )( resid 32 and name HD2# ) 3.6 2.2 2.4
assign ( resid 33 and name HN )( resid 33 and name HA ) 2.9 2.2 1.3
assign ( resid 33 and name HN )( resid 33 and name HB1 ) 2.9 2.2 1.3
assign ( resid 33 and name HN )( resid 33 and name HD2 ) 3.4 2.2 2.2
assign ( resid 33 and name HN )( resid 34 and name HN ) 3.4 2.2 2.2
assign ( resid 34 and name HA# )( resid 33 and name HA ) 3.6 2.2 2.4
assign ( resid 34 and name HA# )( resid 34 and name HA# ) 3.6 2.2 2.4
assign ( resid 34 and name HN )( resid 33 and name HA ) 3.6 2.2 2.4
assign ( resid 34 and name HN )( resid 34 and name HA1 ) 3.4 2.2 2.2
assign ( resid 34 and name HN )( resid 34 and name HA2 ) 3.4 2.2 2.2
assign ( resid 34 and name HN )( resid 35 and name HN ) 2.9 2.2 1.3
!assign ( resid 35 and name HA )( resid 32 and name HA ) 3.6 2.2 2.4
assign ( resid 35 and name HA )( resid 35 and name HD1# ) 3.2 2.2 1.5
assign ( resid 35 and name HA )( resid 35 and name HD2# ) 3.6 2.2 2.4
assign ( resid 35 and name HB# )( resid 35 and name HA ) 3.4 2.2 2.2
assign ( resid 35 and name HB# )( resid 35 and name HD1# ) 3.4 2.2 2.2
assign ( resid 35 and name HB# )( resid 35 and name HD2# ) 3.4 2.2 2.2
assign ( resid 35 and name HB# )( resid 35 and name HG ) 2.9 2.2 1.2
assign ( resid 35 and name HD1# )( resid 32 and name HD2 ) 3.4 2.2 2.2
assign ( resid 35 and name HD1# )( resid 64 and name HD1# ) 3.9 2.2 2.2
assign ( resid 35 and name HD1# )( resid 64 and name HD2# ) 3.9 2.2 2.2
assign ( resid 35 and name HD1# )( resid 98 and name HD1 ) 3.9 2.2 2.2
assign ( resid 35 and name HD2# )( resid 32 and name HD2 ) 3.9 2.2 2.2
assign ( resid 35 and name HD2# )( resid 35 and name HD1# ) 3.4 2.2 2.2
assign ( resid 35 and name HD2# )( resid 64 and name HD1# ) 3.9 2.2 2.2
assign ( resid 35 and name HD2# )( resid 64 and name HD2# ) 3.9 2.2 2.2
assign ( resid 35 and name HG )( resid 36 and name HN ) 2.9 2.2 1.2
assign ( resid 35 and name HG )( resid 35 and name HA ) 2.9 2.2 1.2
assign ( resid 35 and name HN )( resid 32 and name HB2 ) 3.4 2.2 2.2
assign ( resid 35 and name HN )( resid 32 and name HD2# ) 3.6 2.2 2.4
assign ( resid 35 and name HN )( resid 34 and name HA1 ) 2.9 2.2 1.2
assign ( resid 35 and name HN )( resid 34 and name HA2 ) 2.4 2.2 0.7
assign ( resid 35 and name HN )( resid 35 and name HA ) 2.4 2.2 0.7
assign ( resid 35 and name HN )( resid 35 and name HB# ) 2.4 2.2 0.7
assign ( resid 35 and name HN )( resid 35 and name HD1# ) 3.2 2.2 1.5
assign ( resid 35 and name HN )( resid 35 and name HD2# ) 3.6 2.2 2.4
assign ( resid 35 and name HN )( resid 35 and name HG ) 3.4 2.2 2.2
assign ( resid 35 and name HN )( resid 36 and name HN ) 2.4 2.2 0.7
assign ( resid 35 and name HN )( resid 36 and name HB2 ) 3.4 2.2 2.2
assign ( resid 36 and name HA )( resid 36 and name HB1 ) 2.9 2.2 1.2
assign ( resid 36 and name HA )( resid 36 and name HB2 ) 2.9 2.2 1.2
assign ( resid 36 and name HA )( resid 36 and name HD# ) 3.2 2.2 1.5
assign ( resid 36 and name HB1 )( resid 36 and name HD# ) 2.6 2.2 1.0
assign ( resid 36 and name HB2 )( resid 36 and name HD# ) 2.9 2.2 1.2
assign ( resid 36 and name HD# )( resid 102 and name HG2# ) 3.4 2.2 2.2
assign ( resid 36 and name HD2 )( resid 35 and name HD2# ) 3.4 2.2 2.2
assign ( resid 36 and name HD# )( resid 35 and name HG ) 3.4 2.2 2.2
assign ( resid 36 and name HD# )( resid 36 and name HA ) 3.4 2.2 2.2
assign ( resid 36 and name HD# )( resid 36 and name HB1 ) 2.9 2.2 1.2
assign ( resid 36 and name HD# )( resid 60 and name HB# ) 3.4 2.2 2.2 
assign ( resid 36 and name HD# )( resid 64 and name HD1# ) 3.4 2.2 2.2
assign ( resid 36 and name HD# )( resid 64 and name HG ) 3.6 2.2 2.4
assign ( resid 36 and name HD# )( resid 99 and name HA ) 3.4 2.2 2.2
assign ( resid 36 and name HE# )( resid 60 and name HA ) 3.4 2.2 2.2
assign ( resid 36 and name HE2 )( resid 35 and name HD2# ) 3.6 2.2 2.4 
assign ( resid 36 and name HE1 )( resid 61 and name HA ) 3.6 2.2 2.4
assign ( resid 36 and name HE# )( resid 61 and name HB# ) 3.4 2.2 2.2
assign ( resid 36 and name HE# )( resid 61 and name HG# ) 3.6 2.2 2.4
assign ( resid 36 and name HE# )( resid 95 and name HA ) 3.4 2.2 2.2
assign ( resid 36 and name HN )( resid 35 and name HA ) 2.9 2.2 1.2
assign ( resid 36 and name HN )( resid 35 and name HB# ) 3.6 2.2 2.4
assign ( resid 36 and name HN )( resid 35 and name HG ) 3.6 2.2 2.4
assign ( resid 36 and name HN )( resid 36 and name HA ) 2.9 2.2 1.2 
assign ( resid 36 and name HN )( resid 36 and name HB1 ) 2.9 2.2 1.2 
assign ( resid 36 and name HN )( resid 36 and name HB2 ) 2.9 2.2 1.2 
!assign ( resid 36 and name HN )( resid 36 and name HD# ) 2.9 2.2 1.2 
assign ( resid 36 and name HN )( resid 37 and name HN ) 2.9 2.2 1.2 
assign ( resid 36 and name HN )( resid 37 and name HA1 ) 3.6 2.2 2.4
assign ( resid 36 and name HN )( resid 37 and name HA2 ) 3.6 2.2 2.4
assign ( resid 37 and name HA1 )( resid 36 and name HB1 ) 3.6 2.2 2.4
assign ( resid 37 and name HA1 )( resid 36 and name HB2 ) 3.6 2.2 2.4
assign ( resid 37 and name HA1 )( resid 37 and name HA2 ) 2.4 2.2 0.7
assign ( resid 37 and name HA1 )( resid 58 and name HG2 ) 3.2 2.2 1.5
assign ( resid 37 and name HA2 )( resid 36 and name HB2 ) 3.6 2.2 2.4
assign ( resid 37 and name HA2 )( resid 58 and name HG2 ) 3.2 2.2 1.5
!assign ( resid 37 and name HN )( resid 59 and name HN ) 2.9 2.2 1.2 
assign ( resid 37 and name HN )( resid 36 and name HA ) 2.4 2.2 0.7
assign ( resid 37 and name HN )( resid 37 and name HA1 ) 2.4 2.2 0.7
assign ( resid 37 and name HN )( resid 37 and name HA2 ) 2.4 2.2 0.7
assign ( resid 37 and name HN )( resid 38 and name HN ) 2.9 2.2 1.2
assign ( resid 37 and name HN )( resid 38 and name HB# ) 3.4 2.2 2.2
assign ( resid 37 and name HN )( resid 58 and name HG2 ) 3.2 2.2 1.5
assign ( resid 38 and name HA )( resid 37 and name HA1 ) 3.6 2.2 2.4
assign ( resid 38 and name HA )( resid 38 and name HB# ) 3.6 2.2 2.4
assign ( resid 38 and name HA )( resid 38 and name HD# ) 3.4 2.2 2.2
assign ( resid 38 and name HA )( resid 38 and name HG# ) 2.4 2.2 0.7
assign ( resid 38 and name HA )( resid 58 and name HG2 ) 3.6 2.2 2.4
assign ( resid 38 and name HB# )( resid 37 and name HA1 ) 3.6 2.2 2.4
assign ( resid 38 and name HB# )( resid 38 and name HD# ) 2.9 2.2 1.2
assign ( resid 38 and name HB# )( resid 38 and name HG# ) 3.6 2.2 2.4
assign ( resid 38 and name HD# )( resid 38 and name HE ) 3.6 2.2 2.4
assign ( resid 38 and name HD# )( resid 42 and name HN ) 3.4 2.2 2.2
assign ( resid 38 and name HG# )( resid 38 and name HD# ) 2.9 2.2 1.2
assign ( resid 38 and name HN )( resid 36 and name HN ) 3.4 2.2 2.2
assign ( resid 38 and name HN )( resid 37 and name HA2 ) 2.9 2.2 1.2
assign ( resid 38 and name HN )( resid 38 and name HA ) 2.4 2.2 0.7
assign ( resid 38 and name HN )( resid 38 and name HB# ) 2.9 2.2 1.2
assign ( resid 38 and name HN )( resid 38 and name HD# ) 3.4 2.2 2.2
assign ( resid 39 and name HB# )( resid 39 and name HN ) 2.6 2.2 1.0
assign ( resid 39 and name HB# )( resid 39 and name HA ) 3.6 2.2 2.4
assign ( resid 39 and name HB# )( resid 39 and name HD# ) 3.6 2.2 2.4
assign ( resid 39 and name HD# )( resid 39 and name HA ) 3.4 2.2 2.2
assign ( resid 39 and name HD# )( resid 56 and name HA2 ) 3.4 2.2 2.2
assign ( resid 39 and name HE# )( resid 39 and name HA ) 3.4 2.2 2.2
assign ( resid 39 and name HE# )( resid 39 and name HB# ) 3.6 2.2 2.4
assign ( resid 39 and name HE# )( resid 39 and name HG# ) 3.6 2.2 2.4
assign ( resid 39 and name HE# )( resid 57 and name HG1# ) 3.6 2.2 2.4
assign ( resid 39 and name HG# )( resid 39 and name HN ) 3.4 2.2 2.2
assign ( resid 39 and name HG# )( resid 39 and name HA ) 3.6 2.2 2.4
assign ( resid 39 and name HG# )( resid 39 and name HB# ) 2.4 2.2 0.7
!assign ( resid 39 and name HG# )( resid 48 and name HB1 ) 3.6 2.2 2.4
assign ( resid 39 and name HG# )( resid 56 and name HA# ) 3.6 2.2 2.4
assign ( resid 39 and name HN )( resid 38 and name HA ) 2.6 2.2 1.0
assign ( resid 39 and name HN )( resid 38 and name HD# ) 3.4 2.2 2.2
assign ( resid 39 and name HN )( resid 39 and name HA ) 2.9 2.2 1.2
assign ( resid 39 and name HN )( resid 39 and name HB# ) 2.9 2.2 1.2
assign ( resid 39 and name HN )( resid 39 and name HD# ) 3.6 2.2 2.4
assign ( resid 39 and name HN )( resid 39 and name HE# ) 3.6 2.2 2.4
assign ( resid 39 and name HN )( resid 40 and name HN ) 3.4 2.2 2.2
assign ( resid 39 and name HN )( resid 42 and name HE21 ) 3.4 2.2 2.2
assign ( resid 39 and name HN )( resid 42 and name HE22 ) 3.4 2.2 2.2
!assign ( resid 39 and name HN )( resid 48 and name HE2 ) 3.6 2.2 2.4
!assign ( resid 39 and name HN )( resid 52 and name HD22 ) 3.6 2.2 2.4
!assign ( resid 40 and name HA )( resid 38 and name HB# ) 3.6 2.2 2.4
assign ( resid 40 and name HA )( resid 39 and name HA ) 3.6 2.2 2.4
assign ( resid 40 and name HA )( resid 39 and name HE# ) 3.6 2.2 2.4
assign ( resid 40 and name HA )( resid 39 and name HG# ) 3.6 2.2 2.4
assign ( resid 40 and name HA )( resid 40 and name HB ) 2.4 2.2 0.7
assign ( resid 40 and name HA )( resid 42 and name HN ) 3.6 2.2 2.4
assign ( resid 40 and name HA )( resid 57 and name HD1# ) 3.6 2.2 2.4
assign ( resid 40 and name HA )( resid 59 and name HE1 ) 2.9 2.2 1.2
assign ( resid 40 and name HB )( resid 39 and name HG# ) 3.6 2.2 2.4
assign ( resid 40 and name HB )( resid 42 and name HG# ) 3.6 2.2 2.4
assign ( resid 40 and name HB )( resid 55 and name HN ) 3.6 2.2 2.4
assign ( resid 40 and name HB )( resid 59 and name HE1 ) 3.4 2.2 2.2
assign ( resid 40 and name HB )( resid 59 and name HZ2 ) 3.4 2.2 2.2
assign ( resid 40 and name HG2# )( resid 39 and name HA ) 3.6 2.2 2.4
assign ( resid 40 and name HG2# )( resid 40 and name HA ) 2.6 2.2 1.0
assign ( resid 40 and name HG2# )( resid 40 and name HB ) 3.5 1.2 1.2
assign ( resid 40 and name HG2# )( resid 55 and name HN ) 3.6 2.2 2.4
assign ( resid 40 and name HG2# )( resid 57 and name HD1# ) 2.8 1.0 1.0
assign ( resid 40 and name HG2# )( resid 59 and name HE1 ) 3.6 2.2 2.4
assign ( resid 40 and name HG2# )( resid 59 and name HZ2 ) 3.6 2.2 2.4
!assign ( resid 41 and name HA1 )( resid 39 and name HA ) 3.6 2.2 2.4
assign ( resid 41 and name HA1 )( resid 40 and name HA ) 3.6 2.2 2.4
assign ( resid 41 and name HA1 )( resid 41 and name HA2 ) 2.4 2.2 0.7
!assign ( resid 41 and name HA1 )( resid 42 and name HG# ) 3.6 2.2 2.4
assign ( resid 41 and name HA1 )( resid 42 and name HG# ) 3.6 2.2 2.4
assign ( resid 41 and name HN )( resid 40 and name HN ) 3.4 2.2 2.2
assign ( resid 41 and name HN )( resid 40 and name HA ) 2.4 2.2 0.7
assign ( resid 41 and name HN )( resid 40 and name HB ) 2.9 2.2 1.2
assign ( resid 41 and name HN )( resid 40 and name HG2# ) 3.6 2.2 2.4
assign ( resid 41 and name HN )( resid 41 and name HA1 ) 2.9 2.2 1.2
assign ( resid 41 and name HN )( resid 41 and name HA2 ) 2.9 2.2 1.2
assign ( resid 41 and name HN )( resid 42 and name HN ) 2.9 2.2 1.2
assign ( resid 41 and name HN )( resid 42 and name HB# ) 3.6 2.2 2.4
assign ( resid 41 and name HN )( resid 42 and name HG# ) 3.6 2.2 2.4
assign ( resid 41 and name HN )( resid 59 and name HE1 ) 2.9 2.2 1.2
!assign ( resid 41 and name HN )( resid 59 and name HZ2 ) 3.6 2.2 2.4
assign ( resid 42 and name HA )( resid 42 and name HB# ) 3.6 2.2 2.4
assign ( resid 42 and name HA )( resid 42 and name HE21 ) 3.4 2.2 2.2
assign ( resid 42 and name HA )( resid 42 and name HE22 ) 3.6 2.2 2.4
assign ( resid 42 and name HA )( resid 42 and name HG# ) 3.4 2.2 2.3
assign ( resid 42 and name HB# )( resid 42 and name HG# ) 3.4 2.2 2.3
assign ( resid 42 and name HB# )( resid 42 and name HG# ) 3.4 2.2 2.3
assign ( resid 42 and name HG# )( resid 42 and name HE21 ) 3.4 2.2 2.3
assign ( resid 42 and name HG# )( resid 42 and name HE22 ) 2.9 2.2 1.2
assign ( resid 42 and name HG# )( resid 43 and name HN ) 3.4 2.2 2.3
assign ( resid 42 and name HN )( resid 40 and name HA ) 3.4 2.2 2.3
assign ( resid 42 and name HN )( resid 41 and name HA1 ) 2.9 2.2 1.2
assign ( resid 42 and name HN )( resid 41 and name HA2 ) 3.4 2.2 2.3
assign ( resid 42 and name HN )( resid 42 and name HA ) 2.9 2.2 1.2
assign ( resid 42 and name HN )( resid 42 and name HB# ) 3.2 2.2 1.5
assign ( resid 42 and name HN )( resid 42 and name HG# ) 3.4 2.2 2.3
!assign ( resid 42 and name HN )( resid 43 and name HB# ) 3.2 2.2 1.5
assign ( resid 43 and name HA )( resid 42 and name HB# ) 3.4 2.2 2.3
assign ( resid 43 and name HA )( resid 44 and name HA ) 3.6 2.2 2.4
assign ( resid 43 and name HA )( resid 44 and name HB# ) 3.6 2.2 2.4
assign ( resid 43 and name HA )( resid 44 and name HD# ) 3.6 2.2 2.4
assign ( resid 43 and name HA )( resid 44 and name HG# ) 3.6 2.2 2.4
assign ( resid 43 and name HB# )( resid 42 and name HA ) 3.6 2.2 2.4
assign ( resid 43 and name HB# )( resid 43 and name HA ) 3.6 2.2 2.4
assign ( resid 43 and name HB# )( resid 44 and name HA ) 3.6 2.2 2.4
assign ( resid 43 and name HB# )( resid 44 and name HB# ) 3.4 2.2 2.3
assign ( resid 43 and name HB# )( resid 44 and name HD# ) 3.4 2.2 2.2
assign ( resid 43 and name HN )( resid 41 and name HA2 ) 3.6 2.2 2.4
assign ( resid 43 and name HN )( resid 42 and name HN ) 2.9 2.2 1.2
assign ( resid 43 and name HN )( resid 42 and name HB# ) 3.6 2.2 2.4
assign ( resid 43 and name HN )( resid 43 and name HA ) 2.9 2.2 1.2
assign ( resid 43 and name HN )( resid 43 and name HB# ) 3.2 2.2 1.5
assign ( resid 43 and name HN )( resid 44 and name HA ) 3.6 2.2 2.4
!assign ( resid 43 and name HN )( resid 44 and name HB# ) 3.6 2.2 2.4
assign ( resid 43 and name HN )( resid 44 and name HD# ) 3.6 2.2 2.4
assign ( resid 44 and name HA )( resid 44 and name HB# ) 2.9 2.2 1.2
assign ( resid 44 and name HA )( resid 44 and name HD1 ) 3.4 2.2 2.2
assign ( resid 44 and name HA )( resid 44 and name HG# ) 3.6 2.2 2.4
assign ( resid 44 and name HD1 )( resid 44 and name HB# ) 2.9 2.2 1.2
assign ( resid 44 and name HD2 )( resid 44 and name HG# ) 2.9 2.2 1.2
assign ( resid 44 and name HD2 )( resid 44 and name HD1 ) 2.4 2.2 0.7
assign ( resid 45 and name HA1 )( resid 44 and name HB# ) 3.6 2.2 2.4
assign ( resid 45 and name HA1 )( resid 44 and name HG# ) 3.6 2.2 2.4
assign ( resid 45 and name HA2 )( resid 45 and name HA1 ) 2.4 2.2 0.7
assign ( resid 45 and name HN )( resid 44 and name HB# ) 3.6 2.2 2.4
assign ( resid 45 and name HN )( resid 44 and name HG# ) 3.6 2.2 2.4
assign ( resid 45 and name HN )( resid 45 and name HA1 ) 3.4 2.2 2.2
assign ( resid 45 and name HN )( resid 45 and name HA2 ) 3.4 2.2 2.2
assign ( resid 45 and name HN )( resid 46 and name HA ) 3.6 2.2 2.4
assign ( resid 46 and name HA )( resid 26 and name HB1 ) 3.4 2.2 2.2
assign ( resid 46 and name HA )( resid 26 and name HD2 ) 3.6 2.2 2.4
assign ( resid 46 and name HA )( resid 46 and name HB2 ) 2.9 2.2 1.2
assign ( resid 46 and name HB1 )( resid 26 and name HD2 ) 3.6 2.2 2.4
assign ( resid 46 and name HB1 )( resid 46 and name HA ) 2.9 2.2 1.2
assign ( resid 46 and name HB2 )( resid 46 and name HB1 ) 2.9 2.2 1.2
assign ( resid 46 and name HB2 )( resid 46 and name HD1 ) 3.9 2.2 2.2
assign ( resid 46 and name HB2 )( resid 46 and name HD2 ) 2.9 2.2 1.2
assign ( resid 46 and name HD1 )( resid 46 and name HA ) 3.9 2.2 2.2
assign ( resid 46 and name HD1 )( resid 46 and name HD2 ) 3.9 2.2 2.2
assign ( resid 46 and name HD2 )( resid 46 and name HA ) 3.6 2.2 2.4
assign ( resid 46 and name HE2 )( resid 26 and name HB# ) 4.0 2.2 2.4
assign ( resid 46 and name HN )( resid 26 and name HB1 ) 3.4 2.2 2.2
assign ( resid 46 and name HN )( resid 45 and name HN ) 2.9 2.2 1.2
assign ( resid 46 and name HN )( resid 45 and name HA1 ) 2.9 2.2 1.2
assign ( resid 46 and name HN )( resid 46 and name HA ) 2.4 2.2 0.7
assign ( resid 46 and name HN )( resid 46 and name HB1 ) 2.4 2.2 0.7
assign ( resid 46 and name HN )( resid 46 and name HD1 ) 3.6 2.2 2.4
assign ( resid 46 and name HN )( resid 47 and name HN ) 3.4 2.2 2.2
!assign ( resid 46 and name HN )( resid 47 and name HA ) 3.2 2.2 1.5
assign ( resid 47 and name HA )( resid 46 and name HD1 ) 3.9 2.2 2.2
assign ( resid 47 and name HA )( resid 46 and name HD2 ) 3.9 2.2 2.2
assign ( resid 47 and name HA )( resid 47 and name HG2# ) 3.6 2.2 2.4
assign ( resid 47 and name HB )( resid 46 and name HA ) 3.6 2.2 2.4
assign ( resid 47 and name HB )( resid 47 and name HG2# ) 2.6 2.2 1.0
assign ( resid 47 and name HB )( resid 48 and name HN ) 3.4 2.2 2.2
assign ( resid 47 and name HN )( resid 46 and name HA ) 2.4 2.2 0.7
assign ( resid 47 and name HN )( resid 46 and name HB1 ) 3.2 2.2 1.5
assign ( resid 47 and name HN )( resid 48 and name HA ) 3.4 2.2 2.2
assign ( resid 47 and name HN )( resid 47 and name HA ) 2.9 2.2 1.2
assign ( resid 47 and name HN )( resid 47 and name HA ) 3.4 2.2 2.2
assign ( resid 47 and name HN )( resid 47 and name HB ) 2.4 2.2 0.7
assign ( resid 47 and name HN )( resid 47 and name HG2# ) 3.6 2.2 2.4
assign ( resid 48 and name HA )( resid 48 and name HB1 ) 2.9 2.2 1.2
assign ( resid 48 and name HA )( resid 48 and name HB2 ) 3.4 2.2 2.2
assign ( resid 48 and name HB1 )( resid 49 and name HG2 ) 3.6 2.2 2.4
assign ( resid 48 and name HB1 )( resid 49 and name HN ) 2.9 2.2 1.2
assign ( resid 48 and name HB1 )( resid 52 and name HB1 ) 3.6 2.2 2.4
assign ( resid 48 and name HB2 )( resid 49 and name HN ) 2.9 2.2 1.2
assign ( resid 48 and name HN )( resid 47 and name HA ) 2.4 2.2 0.7
assign ( resid 48 and name HN )( resid 47 and name HG2# ) 3.4 2.2 2.2
assign ( resid 48 and name HN )( resid 48 and name HA ) 3.4 2.2 2.2
assign ( resid 48 and name HN )( resid 48 and name HB1 ) 2.9 2.2 1.2
assign ( resid 48 and name HN )( resid 48 and name HB2 ) 2.9 2.2 1.2
assign ( resid 48 and name HN )( resid 49 and name HN ) 3.4 2.2 2.2
assign ( resid 49 and name HA )( resid 49 and name HB ) 2.9 2.2 1.2
assign ( resid 49 and name HA )( resid 49 and name HG2 ) 2.6 2.2 1.0
assign ( resid 49 and name HA )( resid 50 and name HB# ) 3.4 2.2 2.2
assign ( resid 49 and name HB )( resid 49 and name HG2 ) 2.6 2.2 1.0
assign ( resid 49 and name HB )( resid 50 and name HB# ) 3.4 2.2 2.2
assign ( resid 49 and name HN )( resid 48 and name HA ) 2.4 2.2 0.7
assign ( resid 49 and name HN )( resid 48 and name HB1 ) 2.9 2.2 1.2
assign ( resid 49 and name HN )( resid 48 and name HB2 ) 2.9 2.2 1.2
assign ( resid 49 and name HN )( resid 48 and name HD2 ) 3.6 2.2 2.4
!assign ( resid 49 and name HN )( resid 48 and name HE2 ) 3.6 2.2 2.4
assign ( resid 49 and name HN )( resid 49 and name HA ) 2.4 2.2 0.7
assign ( resid 49 and name HN )( resid 49 and name HB ) 2.9 2.2 1.2
assign ( resid 49 and name HN )( resid 49 and name HG2 ) 3.2 2.2 1.5
assign ( resid 49 and name HN )( resid 50 and name HA ) 3.4 2.2 2.2
assign ( resid 50 and name HA )( resid 51 and name HA ) 3.4 2.2 2.2
assign ( resid 50 and name HA )( resid 51 and name HB# ) 3.6 2.2 2.4
assign ( resid 50 and name HA )( resid 53 and name HD# ) 3.6 2.2 2.4
assign ( resid 50 and name HA )( resid 53 and name HE2 ) 3.6 2.2 2.4
assign ( resid 50 and name HA )( resid 54 and name HN ) 3.6 2.2 2.4
assign ( resid 50 and name HA )( resid 54 and name HD21 ) 3.6 2.2 2.4
assign ( resid 50 and name HA )( resid 54 and name HD22 ) 3.6 2.2 2.4
assign ( resid 50 and name HB# )( resid 50 and name HA ) 2.4 2.2 0.7
assign ( resid 50 and name HN )( resid 49 and name HN ) 3.4 2.2 2.2
assign ( resid 50 and name HN )( resid 49 and name HA ) 2.6 2.2 1.0
assign ( resid 50 and name HN )( resid 49 and name HB ) 2.4 2.2 0.7
assign ( resid 50 and name HN )( resid 49 and name HG2 ) 3.6 2.2 2.4
assign ( resid 50 and name HN )( resid 50 and name HA ) 2.4 2.2 0.7
assign ( resid 50 and name HN )( resid 50 and name HB# ) 2.9 2.2 1.2
assign ( resid 50 and name HN )( resid 51 and name HN ) 2.9 2.2 1.2
assign ( resid 50 and name HN )( resid 51 and name HA ) 3.4 2.2 2.2
assign ( resid 51 and name HA )( resid 50 and name HB# ) 3.6 2.2 2.4
assign ( resid 51 and name HA )( resid 54 and name HB2 ) 3.0 2.2 1.2
assign ( resid 51 and name HA )( resid 54 and name HB1 ) 3.4 2.2 2.2
assign ( resid 51 and name HA )( resid 75 and name HG1# ) 3.6 2.2 2.4
assign ( resid 51 and name HA )( resid 75 and name HG2# ) 3.2 2.2 1.5
assign ( resid 51 and name HB# )( resid 49 and name HB ) 3.2 2.2 1.5
assign ( resid 51 and name HB# )( resid 50 and name HN ) 3.6 2.2 2.4
assign ( resid 51 and name HB# )( resid 50 and name HB# ) 3.9 2.2 2.2
assign ( resid 51 and name HB# )( resid 51 and name HN ) 2.9 2.2 1.2
assign ( resid 51 and name HB# )( resid 51 and name HA ) 2.6 2.2 1.0
assign ( resid 51 and name HB# )( resid 52 and name HN ) 3.2 2.2 1.5
assign ( resid 51 and name HB# )( resid 52 and name HA ) 3.6 2.2 2.4
assign ( resid 51 and name HB# )( resid 52 and name HB2 ) 3.6 2.2 2.4
assign ( resid 51 and name HB# )( resid 75 and name HG1# ) 3.6 2.2 2.4
assign ( resid 51 and name HB# )( resid 75 and name HG2# ) 3.4 2.2 2.2
!assign ( resid 51 and name HB# )( resid 77 and name HN ) 3.6 2.2 2.4
assign ( resid 51 and name HB# )( resid 78 and name HN ) 3.6 2.2 2.4
assign ( resid 51 and name HN )( resid 49 and name HN ) 3.4 2.2 2.2
assign ( resid 51 and name HN )( resid 49 and name HB ) 2.4 2.2 0.7
assign ( resid 51 and name HN )( resid 50 and name HB# ) 2.6 2.2 1.0
assign ( resid 51 and name HN )( resid 51 and name HA ) 2.4 2.2 0.7
assign ( resid 51 and name HN )( resid 51 and name HB# ) 2.6 2.2 1.0
assign ( resid 51 and name HN )( resid 52 and name HN ) 2.4 2.2 0.7
assign ( resid 51 and name HN )( resid 52 and name HB# ) 3.6 2.2 2.4
assign ( resid 52 and name HA )( resid 52 and name HD21 ) 3.6 2.2 2.4
assign ( resid 52 and name HA )( resid 53 and name HN ) 3.4 2.2 2.2
assign ( resid 52 and name HB# )( resid 52 and name HA ) 2.9 2.2 1.2
assign ( resid 52 and name HB# )( resid 53 and name HN ) 2.9 2.2 1.2
assign ( resid 52 and name HB# )( resid 53 and name HA ) 3.4 2.2 2.3
!assign ( resid 52 and name HD21 )( resid 38 and name HN ) 3.6 2.2 2.4
assign ( resid 52 and name HD21 )( resid 41 and name HN ) 3.4 2.2 2.3
assign ( resid 52 and name HD22 )( resid 59 and name HE1 ) 3.4 2.2 2.3
assign ( resid 52 and name HD22 )( resid 59 and name HZ2 ) 3.4 2.2 2.3
!assign ( resid 52 and name HD22 )( resid 75 and name HD1# ) 3.2 2.2 1.5
assign ( resid 52 and name HD22 )( resid 75 and name HG2# ) 3.6 2.2 2.4
assign ( resid 52 and name HN )( resid 49 and name HN ) 3.4 2.2 2.3
assign ( resid 52 and name HN )( resid 51 and name HA ) 2.9 2.2 1.2
assign ( resid 52 and name HN )( resid 52 and name HA ) 2.9 2.2 1.2
assign ( resid 52 and name HN )( resid 52 and name HB# ) 2.4 2.2 0.7
assign ( resid 52 and name HN )( resid 52 and name HB# ) 2.9 2.2 1.2
assign ( resid 52 and name HN )( resid 53 and name HB# ) 3.4 2.2 2.3
assign ( resid 53 and name HA )( resid 53 and name HB1 ) 3.6 2.2 2.4
assign ( resid 53 and name HA )( resid 53 and name HB2 ) 3.4 2.2 2.2
assign ( resid 53 and name HA )( resid 53 and name HD# ) 3.4 2.2 2.2
assign ( resid 53 and name HA )( resid 53 and name HG# ) 2.9 2.2 1.2
assign ( resid 53 and name HA )( resid 55 and name HN ) 3.6 2.2 2.4
assign ( resid 53 and name HG# )( resid 53 and name HB1 ) 3.6 2.2 2.4
assign ( resid 53 and name HG# )( resid 53 and name HD# ) 3.6 2.2 2.4
assign ( resid 53 and name HG# )( resid 54 and name HB# ) 3.6 2.2 2.4
assign ( resid 53 and name HN )( resid 48 and name HB1 ) 2.9 2.2 1.2
assign ( resid 53 and name HN )( resid 48 and name HB2 ) 3.4 2.2 2.2
assign ( resid 53 and name HN )( resid 53 and name HA ) 2.9 2.2 1.2
assign ( resid 53 and name HN )( resid 53 and name HD# ) 3.4 2.2 2.2
assign ( resid 53 and name HN )( resid 53 and name HG# ) 2.9 2.2 1.2
assign ( resid 53 and name HN )( resid 54 and name HN ) 2.4 2.2 0.7
assign ( resid 54 and name HA )( resid 53 and name HB1 ) 3.6 2.2 2.4
assign ( resid 54 and name HA )( resid 53 and name HD# ) 3.6 2.2 2.4
assign ( resid 54 and name HA )( resid 54 and name HD21 ) 3.4 2.2 2.2
assign ( resid 54 and name HA )( resid 54 and name HD22 ) 3.4 2.2 2.2
assign ( resid 54 and name HA )( resid 55 and name HB# ) 3.6 2.2 2.4
assign ( resid 54 and name HB1 )( resid 54 and name HA ) 2.9 2.2 1.2
assign ( resid 54 and name HB1 )( resid 54 and name HD21 ) 2.9 2.2 1.2
assign ( resid 54 and name HB1 )( resid 54 and name HD22 ) 2.9 2.2 1.2
assign ( resid 54 and name HB# )( resid 53 and name HG# ) 3.6 2.2 2.4
assign ( resid 54 and name HB2 )( resid 54 and name HA ) 2.9 2.2 1.2
assign ( resid 54 and name HB2 )( resid 54 and name HD21 ) 3.4 2.2 2.2
assign ( resid 54 and name HB2 )( resid 54 and name HD22 ) 3.4 2.2 2.2
assign ( resid 54 and name HB2 )( resid 55 and name HN ) 2.9 2.2 1.2
assign ( resid 54 and name HN )( resid 51 and name HA ) 2.9 2.2 1.2
assign ( resid 54 and name HN )( resid 53 and name HG# ) 3.4 2.2 2.2
assign ( resid 54 and name HN )( resid 54 and name HA ) 2.4 2.2 0.7
assign ( resid 54 and name HN )( resid 54 and name HB2 ) 2.9 2.2 1.2
assign ( resid 54 and name HN )( resid 54 and name HD21 ) 3.4 2.2 2.2
assign ( resid 54 and name HN )( resid 54 and name HD22 ) 2.9 2.2 1.2
assign ( resid 54 and name HN )( resid 55 and name HB# ) 3.6 2.2 2.4
assign ( resid 54 and name HN )( resid 56 and name HN ) 3.4 2.2 2.2
assign ( resid 55 and name HA )( resid 55 and name HG2 ) 3.6 2.2 2.4
assign ( resid 55 and name HB# )( resid 55 and name HA ) 3.6 2.2 2.4
assign ( resid 55 and name HB# )( resid 55 and name HG2 ) 3.6 2.2 2.4
assign ( resid 55 and name HD# )( resid 55 and name HN ) 3.4 2.2 2.2
assign ( resid 55 and name HN )( resid 54 and name HN ) 2.9 2.2 1.2
assign ( resid 55 and name HN )( resid 54 and name HA ) 2.9 2.2 1.2
assign ( resid 55 and name HN )( resid 54 and name HB1 ) 2.9 2.2 1.2
assign ( resid 55 and name HN )( resid 54 and name HD21 ) 2.9 2.2 1.2
assign ( resid 55 and name HN )( resid 54 and name HD22 ) 3.6 2.2 2.4
assign ( resid 55 and name HN )( resid 55 and name HA ) 2.4 2.2 0.7
assign ( resid 55 and name HN )( resid 55 and name HB# ) 2.9 2.2 1.2
assign ( resid 55 and name HN )( resid 55 and name HG# ) 3.4 2.2 2.2
assign ( resid 55 and name HN )( resid 56 and name HN ) 2.9 2.2 1.2
assign ( resid 56 and name HA1 )( resid 56 and name HA2 ) 3.4 2.2 2.2
assign ( resid 56 and name HN )( resid 40 and name HN ) 3.4 2.2 2.2
assign ( resid 56 and name HN )( resid 55 and name HB# ) 3.4 2.2 2.2
assign ( resid 56 and name HN )( resid 56 and name HA1 ) 2.4 2.2 0.7
assign ( resid 56 and name HN )( resid 56 and name HA2 ) 2.9 2.2 1.2
assign ( resid 56 and name HN )( resid 57 and name HB ) 3.6 2.2 2.4
assign ( resid 57 and name HA )( resid 40 and name HG2# ) 3.4 2.2 2.2
assign ( resid 57 and name HA )( resid 56 and name HA# ) 3.4 2.2 2.2
assign ( resid 57 and name HA )( resid 57 and name HG13 ) 2.9 2.2 1.2
assign ( resid 57 and name HA )( resid 57 and name HG12 ) 2.9 2.2 1.2
assign ( resid 57 and name HA )( resid 57 and name HG2# ) 3.2 2.2 1.5
assign ( resid 57 and name HB )( resid 40 and name HG2# ) 3.4 2.2 2.2
assign ( resid 57 and name HB )( resid 57 and name HA ) 2.4 2.2 0.7
assign ( resid 57 and name HB )( resid 57 and name HD1# ) 2.6 2.2 1.0
assign ( resid 57 and name HB )( resid 57 and name HG13 ) 3.4 2.2 2.2
assign ( resid 57 and name HB )( resid 57 and name HG12 ) 3.4 2.2 2.2
assign ( resid 57 and name HB )( resid 57 and name HG2# ) 2.6 2.2 1.0
assign ( resid 57 and name HD1# )( resid 40 and name HG2# ) 2.6 2.2 1.0
assign ( resid 57 and name HD1# )( resid 57 and name HA ) 3.4 2.2 2.2
assign ( resid 57 and name HD1# )( resid 57 and name HG12 ) 3.4 2.2 2.2
assign ( resid 57 and name HD1# )( resid 57 and name HG13 ) 3.4 2.2 2.2
assign ( resid 57 and name HD1# )( resid 63 and name HG2 ) 3.9 2.2 2.2
assign ( resid 57 and name HG12 )( resid 40 and name HG2# ) 3.2 2.2 1.5
assign ( resid 57 and name HG12 )( resid 57 and name HG13 ) 2.6 2.2 1.0
assign ( resid 57 and name HG12 )( resid 57 and name HG2# ) 2.6 2.2 1.0
assign ( resid 57 and name HG12# )( resid 57 and name HG2# ) 3.2 2.2 1.5
assign ( resid 57 and name HG2# )( resid 57 and name HD1# ) 3.4 2.2 2.2
!assign ( resid 57 and name HG2# )( resid 58 and name HA ) 3.6 2.2 2.4
assign ( resid 57 and name HN )( resid 40 and name HN ) 3.4 2.2 2.2
assign ( resid 57 and name HN )( resid 40 and name HG2# ) 2.6 2.2 1.0
assign ( resid 57 and name HN )( resid 56 and name HN ) 2.9 2.2 1.2
assign ( resid 57 and name HN )( resid 56 and name HA# ) 3.4 2.2 2.2
assign ( resid 57 and name HN )( resid 57 and name HA ) 2.9 2.2 1.2
assign ( resid 57 and name HN )( resid 57 and name HB ) 2.9 2.2 1.2
assign ( resid 57 and name HN )( resid 57 and name HD1# ) 3.2 2.2 1.5
assign ( resid 57 and name HN )( resid 57 and name HG13 ) 3.2 2.2 1.5
assign ( resid 57 and name HN )( resid 57 and name HG12 ) 3.2 2.2 1.5
assign ( resid 57 and name HN )( resid 57 and name HG2# ) 3.2 2.2 1.5
assign ( resid 58 and name HA )( resid 58 and name HG2 ) 2.6 2.2 1.0
assign ( resid 58 and name HB )( resid 40 and name HG2# ) 3.6 2.2 2.4
assign ( resid 58 and name HB )( resid 57 and name HA ) 3.6 2.2 2.4
assign ( resid 58 and name HB )( resid 57 and name HB ) 3.6 2.2 2.4
!assign ( resid 58 and name HB )( resid 57 and name HG2# ) 3.6 2.2 2.4
assign ( resid 58 and name HB )( resid 58 and name HA ) 3.6 2.2 2.4
assign ( resid 58 and name HB )( resid 63 and name HG2 ) 3.6 2.2 2.4
assign ( resid 58 and name HG2 )( resid 40 and name HN ) 3.6 2.2 2.4
assign ( resid 58 and name HG2 )( resid 40 and name HA ) 3.6 2.2 2.4
assign ( resid 58 and name HG2 )( resid 40 and name HB ) 3.6 2.2 2.4
assign ( resid 58 and name HG2 )( resid 58 and name HB ) 2.6 2.2 1.0
assign ( resid 58 and name HN )( resid 57 and name HN ) 3.4 2.2 2.2
assign ( resid 58 and name HN )( resid 57 and name HA ) 2.4 2.2 0.7
assign ( resid 58 and name HN )( resid 57 and name HD1# ) 3.6 2.2 2.4
assign ( resid 58 and name HN )( resid 57 and name HG2# ) 3.2 2.2 1.5
assign ( resid 58 and name HN )( resid 58 and name HA ) 2.9 2.2 1.2
assign ( resid 58 and name HN )( resid 58 and name HB ) 2.4 2.2 0.7
assign ( resid 58 and name HN )( resid 58 and name HG2 ) 3.2 2.2 1.5
assign ( resid 59 and name HA )( resid 59 and name HB1 ) 3.4 2.2 2.2
assign ( resid 59 and name HA )( resid 59 and name HB2 ) 3.4 2.2 2.2
assign ( resid 59 and name HA )( resid 36 and name HA ) 3.6 2.2 2.4
assign ( resid 59 and name HB1 )( resid 35 and name HD1 ) 3.2 2.2 1.5
assign ( resid 59 and name HB1 )( resid 35 and name HD2 ) 3.6 2.2 2.4
assign ( resid 59 and name HB1 )( resid 35 and name HG ) 3.6 2.2 2.4
assign ( resid 59 and name HB1 )( resid 40 and name HB ) 4.2 2.2 2.7
assign ( resid 59 and name HB1 )( resid 59 and name HB2 ) 3.4 2.2 2.2
assign ( resid 59 and name HB1 )( resid 59 and name HE1 ) 3.4 2.2 2.2
assign ( resid 59 and name HB2 )( resid 35 and name HD2# ) 3.6 2.2 2.4
!assign ( resid 59 and name HB2 )( resid 37 and name HA1 ) 3.6 2.2 2.4
assign ( resid 59 and name HB2 )( resid 59 and name HE1 ) 3.4 2.2 2.2
assign ( resid 59 and name HB2 )( resid 60 and name HN ) 2.9 2.2 1.2
assign ( resid 59 and name HD1 )( resid 35 and name HD1 ) 3.6 2.2 2.4
assign ( resid 59 and name HD1 )( resid 35 and name HD2 ) 3.6 2.2 2.4
assign ( resid 59 and name HD1 )( resid 40 and name HA ) 3.6 2.2 2.4
assign ( resid 59 and name HD1 )( resid 59 and name HN ) 2.9 2.2 1.2
assign ( resid 59 and name HD1 )( resid 59 and name HA ) 3.4 2.2 2.2
assign ( resid 59 and name HD1 )( resid 59 and name HB1 ) 3.6 2.2 2.4
assign ( resid 59 and name HD1 )( resid 59 and name HB2 ) 3.6 2.2 2.4
assign ( resid 59 and name HE1 )( resid 59 and name HD1 ) 2.9 2.2 1.2
assign ( resid 59 and name HH2 )( resid 59 and name HE1 ) 3.6 2.2 2.4
assign ( resid 59 and name HH2 )( resid 59 and name HZ3 ) 3.6 2.2 2.4
assign ( resid 59 and name HN )( resid 57 and name HD1# ) 3.6 2.2 2.4
assign ( resid 59 and name HN )( resid 58 and name HN ) 3.6 2.2 2.4
assign ( resid 59 and name HN )( resid 58 and name HA ) 3.6 2.2 2.4
assign ( resid 59 and name HN )( resid 59 and name HA ) 2.9 2.2 1.2
assign ( resid 59 and name HN )( resid 59 and name HB1 ) 2.9 2.2 1.2
assign ( resid 59 and name HN )( resid 59 and name HB2 ) 2.9 2.2 1.2
assign ( resid 59 and name HN )( resid 60 and name HA ) 3.4 2.2 2.2
assign ( resid 59 and name HN )( resid 60 and name HN ) 3.4 2.2 2.2
!assign ( resid 59 and name HN )( resid 60 and name HD1 ) 3.6 2.2 2.4
assign ( resid 59 and name HN )( resid 64 and name HD1 ) 3.6 2.2 2.4
assign ( resid 59 and name HZ3 )( resid 59 and name HE1 ) 3.6 2.2 2.4
assign ( resid 60 and name HA )( resid 36 and name HD1 ) 2.9 2.2 1.2
assign ( resid 60 and name HA )( resid 60 and name HB# ) 2.9 2.2 1.2
assign ( resid 60 and name HA )( resid 60 and name HD1 ) 3.4 2.2 2.2
assign ( resid 60 and name HA )( resid 60 and name HD2 ) 3.6 2.2 2.4
assign ( resid 60 and name HA )( resid 61 and name HA ) 3.6 2.2 2.4
assign ( resid 60 and name HB# )( resid 36 and name HD# ) 3.4 2.2 2.2
assign ( resid 60 and name HB# )( resid 60 and name HD1 ) 3.6 2.2 2.4
assign ( resid 60 and name HB# )( resid 60 and name HD2 ) 3.6 2.2 2.4
assign ( resid 60 and name HB# )( resid 60 and name HE# ) 3.6 2.2 2.4
assign ( resid 60 and name HB# )( resid 60 and name HG# ) 3.6 2.2 2.4
!assign ( resid 60 and name HD1 )( resid 60 and name HD2 ) 3.6 2.2 2.4
assign ( resid 60 and name HG# )( resid 60 and name HA ) 3.6 2.2 2.4
assign ( resid 60 and name HG# )( resid 60 and name HD1 ) 3.6 2.2 2.4
assign ( resid 60 and name HG# )( resid 60 and name HD2 ) 3.6 2.2 2.4
assign ( resid 60 and name HG# )( resid 60 and name HE# ) 3.6 2.2 2.4
assign ( resid 60 and name HN )( resid 59 and name HA ) 2.4 2.2 0.7
assign ( resid 60 and name HN )( resid 59 and name HB2 ) 2.9 2.2 1.2
assign ( resid 60 and name HN )( resid 60 and name HA ) 2.9 2.2 1.2
assign ( resid 60 and name HN )( resid 60 and name HB# ) 3.2 2.2 1.0
assign ( resid 60 and name HN )( resid 60 and name HD2 ) 3.6 2.2 2.4
assign ( resid 60 and name HN )( resid 60 and name HG# ) 2.9 2.2 1.2
assign ( resid 61 and name HA )( resid 36 and name HD# ) 3.6 2.2 2.4
assign ( resid 61 and name HA )( resid 36 and name HE# ) 3.6 2.2 2.4
assign ( resid 61 and name HA )( resid 36 and name HZ )  3.6 2.2 2.4
assign ( resid 61 and name HA )( resid 61 and name HB# ) 2.9 2.2 1.2
assign ( resid 61 and name HA )( resid 61 and name HG# ) 2.9 2.2 1.2
assign ( resid 61 and name HA )( resid 95 and name HD1# ) 3.6 2.2 2.4
assign ( resid 61 and name HA )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 61 and name HB# )( resid 60 and name HA ) 3.6 2.2 2.4
assign ( resid 61 and name HB# )( resid 64 and name HB2 ) 3.6 2.2 2.4
assign ( resid 61 and name HB# )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 61 and name HB# )( resid 36 and name HD# ) 3.6 2.2 2.4
assign ( resid 61 and name HB# )( resid 64 and name HB2 ) 3.6 2.2 2.4
assign ( resid 61 and name HG# )( resid 60 and name HA ) 3.6 2.2 2.4
assign ( resid 61 and name HG# )( resid 61 and name HN ) 2.9 2.2 1.2
assign ( resid 61 and name HG# )( resid 61 and name HA ) 2.9 2.2 1.2
assign ( resid 61 and name HG# )( resid 61 and name HB# ) 2.4 2.2 0.7
assign ( resid 61 and name HG# )( resid 36 and name HD1 ) 3.4 2.2 2.2 
assign ( resid 61 and name HG# )( resid 36 and name HE# ) 3.6 2.2 2.4
assign ( resid 61 and name HG# )( resid 36 and name HZ ) 3.6 2.2 2.4
assign ( resid 61 and name HG# )( resid 95 and name HD1# ) 3.4 2.2 2.2 
assign ( resid 61 and name HG# )( resid 95 and name HG2# ) 3.4 2.2 2.2 
assign ( resid 61 and name HN )( resid 60 and name HA ) 2.9 2.2 1.2
assign ( resid 61 and name HN )( resid 60 and name HB# ) 2.9 2.2 1.2
assign ( resid 61 and name HN )( resid 60 and name HD1 ) 2.9 2.2 1.2
assign ( resid 61 and name HN )( resid 60 and name HD2 ) 2.9 2.2 1.2
assign ( resid 61 and name HN )( resid 60 and name HG# ) 3.4 2.2 2.2
assign ( resid 61 and name HN )( resid 61 and name HA ) 2.9 2.2 1.2
assign ( resid 61 and name HN )( resid 61 and name HB# ) 2.4 2.2 0.7
assign ( resid 61 and name HN )( resid 62 and name HN ) 2.9 2.2 1.2
assign ( resid 62 and name HA )( resid 60 and name HE# ) 3.6 2.2 2.4
assign ( resid 62 and name HA )( resid 63 and name HG2 ) 3.6 2.2 2.4
assign ( resid 62 and name HB# )( resid 62 and name HA ) 3.6 2.2 2.4
assign ( resid 62 and name HG# )( resid 62 and name HA ) 3.6 2.2 2.4
assign ( resid 62 and name HG# )( resid 62 and name HB# ) 3.6 2.2 2.4
assign ( resid 62 and name HN )( resid 60 and name HD1 ) 3.6 2.2 2.4
assign ( resid 62 and name HN )( resid 60 and name HD2 ) 3.6 2.2 2.4
assign ( resid 62 and name HN )( resid 60 and name HG# ) 3.6 2.2 2.4
assign ( resid 62 and name HN )( resid 61 and name HA ) 3.6 2.2 2.4
assign ( resid 62 and name HN )( resid 62 and name HA ) 2.4 2.2 0.7
assign ( resid 62 and name HN )( resid 62 and name HB# ) 2.6 2.2 1.0
assign ( resid 62 and name HN )( resid 62 and name HG# ) 2.9 2.2 1.2
assign ( resid 62 and name HN )( resid 63 and name HA ) 3.6 2.2 2.4
assign ( resid 62 and name HN )( resid 63 and name HG2 ) 3.6 2.2 2.4
assign ( resid 62 and name HN )( resid 64 and name HN ) 3.4 2.2 2.2 
!assign ( resid 63 and name HA )( resid 57 and name HD1# ) 3.6 2.2 2.4
assign ( resid 63 and name HA )( resid 60 and name HE# ) 3.6 2.2 2.4
assign ( resid 63 and name HA )( resid 62 and name HB# ) 3.6 2.2 2.4
assign ( resid 63 and name HA )( resid 63 and name HG2 ) 2.6 2.2 1.0
assign ( resid 63 and name HA )( resid 66 and name HB1 ) 3.6 2.2 2.4
assign ( resid 63 and name HA )( resid 66 and name HG1 ) 3.6 2.2 2.4
assign ( resid 63 and name HB )( resid 60 and name HE# ) 3.6 2.2 2.4
assign ( resid 63 and name HB )( resid 62 and name HB# ) 3.6 2.2 2.4
assign ( resid 63 and name HB )( resid 63 and name HA ) 3.6 2.2 2.4
assign ( resid 63 and name HG2 )( resid 57 and name HD1# ) 3.9 2.2 2.2
assign ( resid 63 and name HG2 )( resid 60 and name HD1 ) 3.6 2.2 2.4
assign ( resid 63 and name HG2 )( resid 60 and name HE# ) 3.6 2.2 2.4
assign ( resid 63 and name HG2 )( resid 66 and name HB1 ) 3.6 2.2 2.4
assign ( resid 63 and name HN )( resid 60 and name HG# ) 3.4 2.2 2.2
assign ( resid 63 and name HN )( resid 62 and name HN ) 2.9 2.2 1.2
assign ( resid 63 and name HN )( resid 62 and name HA ) 2.9 2.2 1.2
assign ( resid 63 and name HN )( resid 62 and name HB# ) 2.9 2.2 1.2
assign ( resid 63 and name HN )( resid 62 and name HG# ) 3.4 2.2 2.2
assign ( resid 63 and name HN )( resid 63 and name HA ) 2.4 2.2 0.7
assign ( resid 63 and name HN )( resid 63 and name HB ) 3.4 2.2 2.2
assign ( resid 63 and name HN )( resid 63 and name HG2 ) 2.6 2.2 1.0
assign ( resid 63 and name HN )( resid 64 and name HA ) 3.6 2.2 2.4
assign ( resid 63 and name HN )( resid 64 and name HG ) 3.6 2.2 2.4
assign ( resid 63 and name HN )( resid 65 and name HN ) 2.9 2.2 1.2
assign ( resid 64 and name HA )( resid 59 and name HA ) 3.4 2.2 2.2
assign ( resid 64 and name HA )( resid 64 and name HG ) 3.6 2.2 2.4
!assign ( resid 64 and name HA )( resid 65 and name HG1 ) 3.6 2.2 2.4
assign ( resid 64 and name HA )( resid 66 and name HG1 ) 3.6 2.2 2.4
assign ( resid 64 and name HA )( resid 67 and name HB2 ) 3.6 2.2 2.4
!assign ( resid 64 and name HA )( resid 95 and name HA ) 3.6 2.2 2.4
!assign ( resid 64 and name HA )( resid 95 and name HD1# ) 3.5 1.5 2.0
assign ( resid 64 and name HB# )( resid 59 and name HA ) 3.6 2.2 2.4
assign ( resid 64 and name HB# )( resid 64 and name HA ) 3.4 2.2 2.2
assign ( resid 64 and name HB# )( resid 64 and name HD2# ) 3.4 2.2 2.2
assign ( resid 64 and name HB# )( resid 64 and name HG ) 2.9 2.2 1.2
assign ( resid 64 and name HB# )( resid 64 and name HD1# ) 3.4 2.2 2.2
assign ( resid 64 and name HD1# )( resid 59 and name HB2 ) 3.6 2.2 2.4
assign ( resid 64 and name HD1# )( resid 64 and name HA ) 3.6 2.2 2.4
assign ( resid 64 and name HD1# )( resid 64 and name HD2# ) 3.4 2.2 2.2
assign ( resid 64 and name HD1# )( resid 64 and name HG ) 2.6 2.2 1.0
assign ( resid 64 and name HD1# )( resid 68 and name HG ) 3.6 2.2 2.4
assign ( resid 64 and name HD1# )( resid 95 and name HB# ) 3.6 2.2 2.4
assign ( resid 64 and name HD1# )( resid 95 and name HD1# ) 3.9 2.2 2.2
assign ( resid 64 and name HD2# )( resid 64 and name HA ) 3.2 2.2 1.5
assign ( resid 64 and name HD2# )( resid 64 and name HB# ) 3.4 2.2 2.2
assign ( resid 64 and name HD2# )( resid 64 and name HG ) 2.6 2.2 1.0
assign ( resid 64 and name HG )( resid 63 and name HB ) 3.4 2.2 2.2
assign ( resid 64 and name HG )( resid 67 and name HB2 ) 3.4 2.2 2.2
assign ( resid 64 and name HN )( resid 61 and name HA ) 3.4 2.2 2.2
assign ( resid 64 and name HN )( resid 63 and name HN ) 2.4 2.2 0.7
assign ( resid 64 and name HN )( resid 63 and name HA ) 2.9 2.2 1.2
assign ( resid 64 and name HN )( resid 63 and name HB ) 2.9 2.2 1.2
assign ( resid 64 and name HN )( resid 63 and name HG2# ) 3.2 2.2 1.5
assign ( resid 64 and name HN )( resid 64 and name HA ) 2.9 2.2 1.2
assign ( resid 64 and name HN )( resid 64 and name HB# ) 2.4 2.2 0.7
assign ( resid 64 and name HN )( resid 64 and name HB# ) 2.9 2.2 1.2
assign ( resid 64 and name HN )( resid 64 and name HD1# ) 3.6 2.2 2.4
assign ( resid 64 and name HN )( resid 64 and name HD2# ) 3.6 2.2 2.4
assign ( resid 64 and name HN )( resid 64 and name HG ) 2.9 2.2 1.2
assign ( resid 64 and name HN )( resid 65 and name HB# ) 3.6 2.2 2.4
assign ( resid 64 and name HN )( resid 66 and name HG1 ) 3.6 2.2 2.4
assign ( resid 64 and name HN )( resid 67 and name HB2 ) 3.4 2.2 2.2
assign ( resid 64 and name HN )( resid 67 and name HN ) 3.4 2.2 2.2
assign ( resid 65 and name HA )( resid 64 and name HN ) 3.6 2.2 2.4
assign ( resid 65 and name HA )( resid 64 and name HB1 ) 3.6 2.2 2.4
assign ( resid 65 and name HA )( resid 65 and name HN ) 2.9 2.2 1.2
assign ( resid 65 and name HA )( resid 65 and name HB# ) 3.6 2.2 2.4
assign ( resid 65 and name HA )( resid 65 and name HE# ) 3.9 2.2 2.2
assign ( resid 65 and name HA )( resid 65 and name HG1 ) 2.9 2.2 1.2
assign ( resid 65 and name HA )( resid 65 and name HG2 ) 2.4 2.2 0.7
assign ( resid 65 and name HA )( resid 66 and name HN ) 2.9 2.2 1.2
assign ( resid 65 and name HA )( resid 66 and name HG2 ) 3.6 2.2 2.4
assign ( resid 65 and name HA )( resid 68 and name HA ) 3.4 2.2 2.2
assign ( resid 65 and name HA )( resid 68 and name HB# ) 2.9 2.2 1.2
assign ( resid 65 and name HA )( resid 68 and name HN ) 3.4 2.2 2.2
assign ( resid 65 and name HA )( resid 68 and name HD1# ) 3.6 2.2 2.4
!assign ( resid 65 and name HA )( resid 95 and name HD1# ) 3.6 2.2 2.4
assign ( resid 65 and name HB# )( resid 62 and name HA ) 3.6 2.2 2.4
assign ( resid 65 and name HB# )( resid 63 and name HG2 ) 3.6 2.2 2.4
assign ( resid 65 and name HB# )( resid 65 and name HG1 ) 3.4 2.2 2.2
assign ( resid 65 and name HB# )( resid 65 and name HG2 ) 3.4 2.2 2.2
assign ( resid 65 and name HE# )( resid 65 and name HN ) 3.6 2.2 2.4
assign ( resid 65 and name HE# )( resid 65 and name HG1 ) 3.6 2.2 2.4
assign ( resid 65 and name HE# )( resid 66 and name HN ) 3.6 2.2 2.4
assign ( resid 65 and name HE# )( resid 68 and name HG ) 3.6 2.2 2.4
assign ( resid 65 and name HE# )( resid 95 and name HG1# ) 3.6 2.2 2.4
assign ( resid 65 and name HE# )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 65 and name HG1 )( resid 65 and name HG2 ) 3.6 2.2 2.4
assign ( resid 65 and name HG2 )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 65 and name HN )( resid 62 and name HA ) 3.6 2.2 2.4
assign ( resid 65 and name HN )( resid 64 and name HN ) 2.9 2.2 1.2
assign ( resid 65 and name HN )( resid 64 and name HA ) 3.6 2.2 2.4
assign ( resid 65 and name HN )( resid 64 and name HB# ) 2.9 2.2 1.2
assign ( resid 65 and name HN )( resid 64 and name HD1# ) 3.6 2.2 2.4
assign ( resid 65 and name HN )( resid 64 and name HG ) 3.6 2.2 2.4
assign ( resid 65 and name HN )( resid 65 and name HB# ) 2.4 2.2 0.7
assign ( resid 65 and name HN )( resid 65 and name HG2 ) 2.6 2.2 1.0
assign ( resid 65 and name HN )( resid 66 and name HN ) 2.9 2.2 1.2
assign ( resid 65 and name HN )( resid 66 and name HG2 ) 3.4 2.2 2.2
assign ( resid 66 and name HB2 )( resid 66 and name HA ) 2.9 2.2 1.2
assign ( resid 66 and name HB2 )( resid 66 and name HG1 ) 3.4 2.2 2.2
assign ( resid 66 and name HB2 )( resid 66 and name HG2 ) 3.4 2.2 2.2
assign ( resid 66 and name HG2 )( resid 66 and name HA ) 3.4 2.2 2.2
assign ( resid 66 and name HG2 )( resid 67 and name HA ) 3.6 2.2 2.4
assign ( resid 66 and name HN )( resid 63 and name HA ) 2.9 2.2 1.2
assign ( resid 66 and name HN )( resid 64 and name HN ) 3.4 2.2 2.2
assign ( resid 66 and name HN )( resid 65 and name HD2# ) 3.4 2.2 2.2
assign ( resid 66 and name HN )( resid 66 and name HA ) 2.9 2.2 1.2
assign ( resid 66 and name HN )( resid 66 and name HB1 ) 2.9 2.2 1.2
assign ( resid 66 and name HN )( resid 66 and name HB2 ) 2.9 2.2 1.2
assign ( resid 66 and name HN )( resid 66 and name HG1 ) 3.4 2.2 2.2
assign ( resid 66 and name HN )( resid 66 and name HG2 ) 2.4 2.2 0.7
assign ( resid 66 and name HN )( resid 67 and name HA ) 3.4 2.2 2.2
assign ( resid 67 and name HA )( resid 67 and name HB1 ) 3.4 2.2 2.2
assign ( resid 67 and name HA )( resid 67 and name HD1 ) 3.4 2.2 2.2
assign ( resid 67 and name HB1 )( resid 64 and name HA ) 3.6 2.2 2.4
assign ( resid 67 and name HB1 )( resid 67 and name HD1 ) 3.4 2.2 2.2
assign ( resid 67 and name HB2 )( resid 67 and name HA ) 3.4 2.2 2.2
assign ( resid 67 and name HB2 )( resid 67 and name HD1 ) 3.4 2.2 2.2
assign ( resid 67 and name HD1 )( resid 74 and name HA ) 3.4 2.2 2.2
assign ( resid 67 and name HD2 )( resid 67 and name HA ) 3.6 2.2 2.4
assign ( resid 67 and name HD2 )( resid 67 and name HB1 ) 3.4 2.2 2.2
assign ( resid 67 and name HD2 )( resid 67 and name HB2 ) 3.4 2.2 2.2
assign ( resid 67 and name HD2 )( resid 64 and name HD1# ) 3.6 2.2 2.4
assign ( resid 67 and name HD2 )( resid 64 and name HD2# ) 3.6 2.2 2.4
assign ( resid 67 and name HD2 )( resid 68 and name HD1# ) 3.6 2.2 2.4
assign ( resid 67 and name HD2 )( resid 68 and name HD2# ) 3.6 2.2 2.4
assign ( resid 67 and name HN )( resid 64 and name HA ) 2.6 2.2 1.0
assign ( resid 67 and name HN )( resid 64 and name HB2 ) 3.4 2.2 2.2
assign ( resid 67 and name HN )( resid 64 and name HD2# ) 3.6 2.2 2.4
assign ( resid 67 and name HN )( resid 64 and name HG ) 3.6 2.2 2.4
assign ( resid 67 and name HN )( resid 66 and name HN ) 2.4 2.2 0.7
assign ( resid 67 and name HN )( resid 66 and name HA ) 2.9 2.2 1.2
assign ( resid 67 and name HN )( resid 66 and name HB1 ) 2.9 2.2 1.2
assign ( resid 67 and name HN )( resid 66 and name HB2 ) 3.4 2.2 2.2
assign ( resid 67 and name HN )( resid 66 and name HG2 ) 3.4 2.2 2.2
assign ( resid 67 and name HN )( resid 67 and name HA ) 2.4 2.2 0.7
assign ( resid 67 and name HN )( resid 67 and name HD1 ) 3.4 2.2 2.2
assign ( resid 67 and name HN )( resid 67 and name HB1 ) 2.9 2.2 1.2
assign ( resid 67 and name HN )( resid 67 and name HB2 ) 2.4 2.2 0.7
assign ( resid 67 and name HN )( resid 69 and name HN ) 3.6 2.2 2.4
assign ( resid 67 and name HN )( resid 74 and name HD# ) 3.6 2.2 2.4
assign ( resid 67 and name HN )( resid 74 and name HD# ) 3.6 2.2 2.4
assign ( resid 68 and name HA )( resid 68 and name HB# ) 2.4 2.2 0.7
assign ( resid 68 and name HA )( resid 68 and name HG ) 2.9 2.2 1.2
assign ( resid 68 and name HB# )( resid 68 and name HD2# ) 3.4 2.2 2.2
assign ( resid 68 and name HB# )( resid 68 and name HG ) 3.4 2.2 2.2
!assign ( resid 68 and name HB# )( resid 64 and name HA ) 3.4 2.2 2.2
assign ( resid 68 and name HB# )( resid 68 and name HD1# ) 3.4 2.2 2.2
assign ( resid 68 and name HB# )( resid 68 and name HD2# ) 3.4 2.2 2.2
assign ( resid 68 and name HB# )( resid 68 and name HG ) 3.4 2.2 2.2
assign ( resid 68 and name HD1# )( resid 65 and name HN ) 3.6 2.2 2.4
assign ( resid 68 and name HD1# )( resid 68 and name HN ) 3.6 2.2 2.4
assign ( resid 68 and name HD1# )( resid 68 and name HA ) 3.6 2.2 2.4
assign ( resid 68 and name HD1# )( resid 68 and name HB# ) 3.4 2.2 2.2
assign ( resid 68 and name HD1# )( resid 68 and name HD2# ) 3.9 2.2 2.2
assign ( resid 68 and name HD1# )( resid 68 and name HG ) 3.6 2.2 2.4
assign ( resid 68 and name HD1# )( resid 69 and name HN ) 3.6 2.2 2.4
!assign ( resid 68 and name HD1# )( resid 95 and name HD1# ) 3.9 2.2 2.2
assign ( resid 68 and name HD2# )( resid 64 and name HD2# ) 3.9 2.2 2.2
assign ( resid 68 and name HD2# )( resid 68 and name HN ) 3.6 2.2 2.4
assign ( resid 68 and name HD2# )( resid 68 and name HA ) 3.2 2.2 1.5
assign ( resid 68 and name HD2# )( resid 69 and name HN ) 3.6 2.2 2.4
!assign ( resid 68 and name HD2# )( resid 95 and name HD1# ) 3.9 2.2 2.2
assign ( resid 68 and name HG )( resid 68 and name HN ) 2.9 2.2 1.2
assign ( resid 68 and name HG )( resid 69 and name HN ) 3.4 2.2 2.2
assign ( resid 68 and name HN )( resid 64 and name HA ) 3.6 2.2 2.4
assign ( resid 68 and name HN )( resid 64 and name HD2# ) 3.6 2.2 2.4
assign ( resid 68 and name HN )( resid 66 and name HN ) 3.6 2.2 2.4
assign ( resid 68 and name HN )( resid 67 and name HA ) 3.6 2.2 2.4
assign ( resid 68 and name HN )( resid 67 and name HB1 ) 3.4 2.2 2.2
assign ( resid 68 and name HN )( resid 67 and name HB2 ) 3.4 2.2 2.2
assign ( resid 68 and name HN )( resid 67 and name HD1 ) 3.4 2.2 2.2
assign ( resid 68 and name HN )( resid 67 and name HD2 ) 3.4 2.2 2.2
assign ( resid 68 and name HN )( resid 68 and name HA ) 2.9 2.2 1.2
assign ( resid 68 and name HN )( resid 68 and name HB# ) 3.4 2.2 2.2
assign ( resid 69 and name HA )( resid 69 and name HG# ) 2.9 2.2 1.2
assign ( resid 69 and name HA )( resid 70 and name HD21 ) 3.6 2.2 2.4
!assign ( resid 69 and name HA )( resid 85 and name HG2# ) 3.6 2.2 2.4
!assign ( resid 69 and name HA )( resid 91 and name HD# ) 3.6 2.2 2.4
assign ( resid 69 and name HB# )( resid 69 and name HA ) 2.9 2.2 1.2
assign ( resid 69 and name HB# )( resid 69 and name HG# ) 2.9 2.2 1.2
assign ( resid 69 and name HB# )( resid 70 and name HD22 ) 3.6 2.2 2.4
assign ( resid 69 and name HG# )( resid 69 and name HA ) 3.6 2.2 2.4
assign ( resid 69 and name HG# )( resid 70 and name HB# ) 3.6 2.2 2.4
assign ( resid 69 and name HN )( resid 67 and name HA ) 3.6 2.2 2.4
assign ( resid 69 and name HN )( resid 67 and name HB1 ) 3.4 2.2 2.2
assign ( resid 69 and name HN )( resid 67 and name HB2 ) 3.6 2.2 2.4
assign ( resid 69 and name HN )( resid 68 and name HN ) 2.9 2.2 1.2
assign ( resid 69 and name HN )( resid 69 and name HA ) 2.9 2.2 1.2
assign ( resid 69 and name HN )( resid 69 and name HB# ) 2.9 2.2 1.2
assign ( resid 69 and name HN )( resid 69 and name HG# ) 2.9 2.2 1.2
assign ( resid 69 and name HN )( resid 70 and name HN ) 2.9 2.2 1.2
assign ( resid 70 and name HA )( resid 71 and name HA ) 3.4 2.2 2.2
assign ( resid 70 and name HB1 )( resid 70 and name HA ) 2.9 2.2 1.2
!assign ( resid 70 and name HB1 )( resid 70 and name HB2 ) 3.6 2.2 2.4
assign ( resid 70 and name HB2 )( resid 70 and name HA ) 2.9 2.2 1.2
assign ( resid 70 and name HB# )( resid 70 and name HD21 ) 3.4 2.2 2.2
assign ( resid 70 and name HB# )( resid 70 and name HD22 ) 3.4 2.2 2.2
assign ( resid 70 and name HB2 )( resid 71 and name HD1 ) 3.4 2.2 2.2
assign ( resid 70 and name HB2 )( resid 71 and name HD2 ) 3.4 2.2 2.2
assign ( resid 70 and name HD21 )( resid 70 and name HD22 ) 2.9 2.2 1.2
assign ( resid 70 and name HN )( resid 69 and name HA ) 2.9 2.2 1.2
assign ( resid 70 and name HN )( resid 69 and name HB# ) 2.9 2.2 1.2
assign ( resid 70 and name HN )( resid 69 and name HG# ) 2.9 2.2 1.2
assign ( resid 70 and name HN )( resid 70 and name HA ) 2.9 2.2 1.2
assign ( resid 70 and name HN )( resid 70 and name HB1 ) 2.9 2.2 1.2
assign ( resid 70 and name HN )( resid 70 and name HB2 ) 2.9 2.2 1.2
assign ( resid 70 and name HN )( resid 70 and name HD21 ) 3.6 2.2 2.4
assign ( resid 70 and name HN )( resid 70 and name HD22 ) 3.6 2.2 2.4
assign ( resid 70 and name HN )( resid 71 and name HG# ) 3.6 2.2 2.4
assign ( resid 70 and name HN )( resid 73 and name HD# ) 3.6 2.2 2.4
assign ( resid 71 and name HA )( resid 70 and name HN ) 3.4 2.2 2.2
assign ( resid 71 and name HA )( resid 70 and name HB# ) 3.6 2.2 2.4
assign ( resid 71 and name HA )( resid 71 and name HB# ) 3.6 2.2 2.4
assign ( resid 71 and name HA )( resid 71 and name HD1 ) 3.4 2.2 2.2
assign ( resid 71 and name HA )( resid 71 and name HD2 ) 3.6 2.2 2.4
assign ( resid 71 and name HA )( resid 71 and name HG# ) 3.6 2.2 2.4
assign ( resid 71 and name HA )( resid 72 and name HN ) 3.6 2.2 2.4
assign ( resid 71 and name HA )( resid 74 and name HD# ) 3.4 2.2 2.2
assign ( resid 71 and name HB1 )( resid 71 and name HB2 ) 2.9 2.2 1.2
assign ( resid 71 and name HB1 )( resid 71 and name HD1 ) 3.6 2.2 2.4
assign ( resid 71 and name HB1 )( resid 71 and name HD2 ) 3.4 2.2 2.2
assign ( resid 71 and name HB# )( resid 71 and name HG# ) 3.6 2.2 2.4
assign ( resid 71 and name HB# )( resid 72 and name HN ) 3.6 2.2 2.4
assign ( resid 71 and name HD1 )( resid 70 and name HN ) 2.9 2.2 1.2
assign ( resid 71 and name HD1 )( resid 70 and name HA ) 3.6 2.2 2.4
assign ( resid 71 and name HD1 )( resid 71 and name HD2 ) 2.4 2.2 0.7
assign ( resid 71 and name HD2 )( resid 72 and name HB# ) 3.6 2.2 2.4
assign ( resid 71 and name HD2 )( resid 70 and name HN ) 3.4 2.2 2.2
assign ( resid 71 and name HD2 )( resid 71 and name HG# ) 3.6 2.2 2.4
assign ( resid 72 and name HA )( resid 72 and name HD# ) 2.9 2.2 1.2
assign ( resid 72 and name HA )( resid 72 and name HG# ) 2.9 2.2 1.2
assign ( resid 72 and name HA )( resid 73 and name HG# ) 3.6 2.2 2.4
assign ( resid 72 and name HA )( resid 74 and name HB# ) 3.6 2.2 2.4
assign ( resid 72 and name HB# )( resid 72 and name HA ) 2.9 2.2 1.2
assign ( resid 72 and name HB# )( resid 72 and name HG# ) 3.2 2.2 1.0
assign ( resid 72 and name HB# )( resid 73 and name HA ) 3.6 2.2 2.4
assign ( resid 72 and name HB# )( resid 73 and name HB# ) 3.6 2.2 2.4
assign ( resid 72 and name HD# )( resid 72 and name HB# ) 3.2 2.2 1.0
assign ( resid 72 and name HD# )( resid 72 and name HG# ) 2.4 2.2 0.7 
assign ( resid 72 and name HD# )( resid 73 and name HA ) 3.6 2.2 2.4
assign ( resid 72 and name HD# )( resid 77 and name HN ) 3.4 2.2 2.2
assign ( resid 72 and name HD# )( resid 76 and name HD# ) 3.6 2.2 2.4
!assign ( resid 72 and name HD# )( resid 78 and name HG2# ) 3.4 2.2 2.2
assign ( resid 72 and name HE# )( resid 72 and name HA ) 2.9 2.2 1.2
assign ( resid 72 and name HE# )( resid 72 and name HB# ) 3.4 2.2 2.2
assign ( resid 72 and name HE# )( resid 72 and name HD# ) 3.2 2.2 1.0
assign ( resid 72 and name HG# )( resid 72 and name HE# ) 2.9 2.2 1.2
assign ( resid 72 and name HG# )( resid 73 and name HA ) 2.9 2.2 1.2
assign ( resid 72 and name HN )( resid 71 and name HB2 ) 3.4 2.2 2.2
assign ( resid 72 and name HN )( resid 71 and name HD2 ) 3.4 2.2 2.2
assign ( resid 72 and name HN )( resid 72 and name HA ) 2.4 2.2 0.7
assign ( resid 72 and name HN )( resid 72 and name HB# ) 2.9 2.2 1.2
assign ( resid 72 and name HN )( resid 72 and name HG# ) 3.4 2.2 2.2
assign ( resid 72 and name HN )( resid 72 and name HD# ) 3.4 2.2 2.2
assign ( resid 72 and name HN )( resid 72 and name HE# ) 3.4 2.2 2.2
assign ( resid 73 and name HA )( resid 70 and name HB# ) 3.6 2.2 2.4
assign ( resid 73 and name HA )( resid 73 and name HB# ) 2.4 2.2 0.7
assign ( resid 73 and name HA )( resid 73 and name HD# ) 3.4 2.2 2.2
assign ( resid 73 and name HA )( resid 73 and name HE# ) 3.4 2.2 2.2
assign ( resid 73 and name HA )( resid 73 and name HG# ) 2.9 2.2 1.2
assign ( resid 73 and name HB# )( resid 73 and name HG# ) 3.4 2.2 2.2
assign ( resid 73 and name HB# )( resid 73 and name HD# ) 3.4 2.2 2.2
assign ( resid 73 and name HB# )( resid 73 and name HE# ) 3.6 2.2 2.4
assign ( resid 73 and name HD# )( resid 73 and name HE# ) 3.4 2.2 2.2
assign ( resid 73 and name HD# )( resid 73 and name HG# ) 3.4 2.2 2.2
assign ( resid 73 and name HG# )( resid 72 and name HN ) 3.4 2.2 2.2
assign ( resid 73 and name HN )( resid 70 and name HN ) 3.6 2.2 2.4
assign ( resid 73 and name HN )( resid 70 and name HB1 ) 3.4 2.2 2.2
assign ( resid 73 and name HN )( resid 70 and name HB2 ) 3.4 2.2 2.2
assign ( resid 73 and name HN )( resid 72 and name HN ) 3.6 2.2 2.4
assign ( resid 73 and name HN )( resid 72 and name HA ) 3.6 2.2 2.4
assign ( resid 73 and name HN )( resid 72 and name HB# ) 3.6 2.2 2.4
assign ( resid 73 and name HN )( resid 72 and name HG# ) 3.6 2.2 2.4
assign ( resid 73 and name HN )( resid 73 and name HA ) 2.4 2.2 0.7
assign ( resid 73 and name HN )( resid 73 and name HB# ) 2.4 2.2 0.7
assign ( resid 73 and name HN )( resid 73 and name HD# ) 3.4 2.2 2.2
assign ( resid 73 and name HN )( resid 73 and name HE# ) 3.6 2.2 2.4
assign ( resid 73 and name HN )( resid 73 and name HG# ) 3.4 2.2 2.2
assign ( resid 73 and name HN )( resid 74 and name HN ) 2.4 2.2 0.7
assign ( resid 73 and name HN )( resid 74 and name HA ) 3.4 2.2 2.2
assign ( resid 73 and name HN )( resid 74 and name HB# ) 3.6 2.2 2.4
assign ( resid 74 and name HA )( resid 75 and name HN ) 2.6 2.2 1.0
assign ( resid 74 and name HA )( resid 67 and name HD1 ) 3.4 2.2 2.2
assign ( resid 74 and name HB1 )( resid 74 and name HA ) 2.9 2.2 1.2
assign ( resid 74 and name HB1 )( resid 74 and name HB2 ) 3.4 2.2 2.2
assign ( resid 74 and name HB1 )( resid 74 and name HD1 ) 3.4 2.2 2.2
assign ( resid 74 and name HB1 )( resid 75 and name HD1# ) 3.4 2.2 2.2
assign ( resid 74 and name HB1 )( resid 67 and name HA ) 3.6 2.2 2.4
assign ( resid 74 and name HB2 )( resid 74 and name HA ) 2.9 2.2 1.2
assign ( resid 74 and name HB2 )( resid 74 and name HD1 ) 3.4 2.2 2.2
assign ( resid 74 and name HB2 )( resid 74 and name HD# ) 3.4 2.2 2.2
assign ( resid 74 and name HB# )( resid 75 and name HA ) 3.6 2.2 2.4
assign ( resid 74 and name HD# )( resid 67 and name HA ) 3.6 2.2 2.4
assign ( resid 74 and name HD# )( resid 67 and name HB1 ) 3.6 2.2 2.4
assign ( resid 74 and name HD# )( resid 67 and name HB2 ) 3.6 2.2 2.4
assign ( resid 74 and name HD1 )( resid 73 and name HE# ) 3.4 2.2 2.2
assign ( resid 74 and name HD1 )( resid 74 and name HA ) 3.2 2.2 1.5
assign ( resid 74 and name HD# )( resid 75 and name HD1 ) 3.6 2.2 2.4
assign ( resid 74 and name HD# )( resid 67 and name HA ) 3.6 2.2 2.4
assign ( resid 74 and name HD# )( resid 67 and name HB1 ) 3.6 2.2 2.4
assign ( resid 74 and name HD# )( resid 67 and name HB2 ) 3.6 2.2 2.4
assign ( resid 74 and name HD# )( resid 74 and name HA ) 3.6 2.2 2.4
assign ( resid 74 and name HD2 )( resid 75 and name HG2 ) 3.6 2.2 2.4
assign ( resid 74 and name HN )( resid 70 and name HB# ) 3.6 2.2 2.4
assign ( resid 74 and name HN )( resid 72 and name HN ) 2.9 2.2 1.2
assign ( resid 74 and name HN )( resid 72 and name HA ) 3.4 2.2 2.2
assign ( resid 74 and name HN )( resid 73 and name HA ) 3.4 2.2 2.2
assign ( resid 74 and name HN )( resid 73 and name HB# ) 3.6 2.2 2.4
assign ( resid 74 and name HN )( resid 73 and name HN ) 2.4 2.2 0.7
assign ( resid 74 and name HN )( resid 74 and name HA ) 2.6 2.2 1.0
assign ( resid 74 and name HN )( resid 74 and name HB1 ) 3.4 2.2 2.2
assign ( resid 74 and name HN )( resid 74 and name HB2 ) 2.4 2.2 0.7
assign ( resid 74 and name HN )( resid 75 and name HN ) 3.4 2.2 2.2
assign ( resid 74 and name HN )( resid 75 and name HB ) 3.6 2.2 2.4
assign ( resid 75 and name HB )( resid 75 and name HA ) 3.6 2.2 2.4
assign ( resid 75 and name HB )( resid 75 and name HD1 ) 3.6 2.2 2.4
assign ( resid 75 and name HB )( resid 75 and name HG1# ) 3.6 2.2 2.4
assign ( resid 75 and name HB )( resid 75 and name HG2# ) 3.6 2.2 2.4
assign ( resid 75 and name HB )( resid 78 and name HB ) 3.6 2.2 2.4
assign ( resid 75 and name HD1 )( resid 55 and name HA ) 3.6 2.2 2.4
assign ( resid 75 and name HD1 )( resid 74 and name HA ) 3.6 2.2 2.4
assign ( resid 75 and name HD1 )( resid 74 and name HB1 ) 3.6 2.2 2.4
assign ( resid 75 and name HD1 )( resid 74 and name HE# ) 3.6 2.2 2.4
assign ( resid 75 and name HD1 )( resid 75 and name HA ) 3.6 2.2 2.4
assign ( resid 75 and name HD1 )( resid 75 and name HG1# ) 3.6 2.2 2.4
assign ( resid 75 and name HD1 )( resid 75 and name HG2# ) 3.4 2.2 2.2
assign ( resid 75 and name HG1# )( resid 75 and name HA ) 3.6 2.2 2.4
assign ( resid 75 and name HG1# )( resid 75 and name HG2# ) 3.6 2.2 2.4
assign ( resid 75 and name HG1# )( resid 74 and name HD# ) 3.6 2.2 2.4
assign ( resid 75 and name HG1# )( resid 75 and name HA ) 3.6 2.2 2.4
assign ( resid 75 and name HG13 )( resid 75 and name HG12 ) 3.6 2.2 2.4
assign ( resid 75 and name HG1# )( resid 75 and name HG2# ) 3.6 2.2 2.4
!assign ( resid 75 and name HG2# )( resid 55 and name HA ) 3.6 2.2 2.4
assign ( resid 75 and name HG2# )( resid 78 and name HN ) 3.6 2.2 2.4
assign ( resid 75 and name HN )( resid 72 and name HA ) 3.6 2.2 2.4
assign ( resid 75 and name HN )( resid 72 and name HB# ) 3.6 2.2 2.4
assign ( resid 75 and name HN )( resid 72 and name HD# ) 3.6 2.2 2.4
assign ( resid 75 and name HN )( resid 73 and name HN ) 3.6 2.2 2.4
assign ( resid 75 and name HN )( resid 74 and name HB1 ) 3.4 2.2 2.2
assign ( resid 75 and name HN )( resid 74 and name HB2 ) 3.4 2.2 2.2
assign ( resid 75 and name HN )( resid 75 and name HA ) 2.4 2.2 0.7
assign ( resid 75 and name HN )( resid 75 and name HB ) 2.9 2.2 1.2
assign ( resid 75 and name HN )( resid 75 and name HD1 ) 3.2 2.2 1.5
assign ( resid 75 and name HN )( resid 75 and name HG2# ) 3.6 2.2 2.4
assign ( resid 76 and name HA )( resid 72 and name HD# ) 3.4 2.2 2.2
assign ( resid 76 and name HA )( resid 75 and name HA ) 3.6 2.2 2.4
!assign ( resid 76 and name HA )( resid 75 and name HG1# ) 3.6 2.2 2.4
assign ( resid 76 and name HA )( resid 76 and name HB# ) 2.9 2.2 1.2
assign ( resid 76 and name HA )( resid 76 and name HD1 ) 3.6 2.2 2.4
assign ( resid 76 and name HA )( resid 76 and name HD2 ) 3.6 2.2 2.4
assign ( resid 76 and name HA )( resid 76 and name HG# ) 3.6 2.2 2.4
assign ( resid 76 and name HA )( resid 78 and name HB ) 3.4 2.2 2.2
assign ( resid 76 and name HA )( resid 78 and name HG2# ) 3.6 2.2 2.4
assign ( resid 76 and name HD# )( resid 72 and name HA ) 3.6 2.2 2.4
assign ( resid 76 and name HD# )( resid 75 and name HN ) 3.4 2.2 2.2
assign ( resid 76 and name HD1 )( resid 75 and name HA ) 3.6 2.2 2.4
assign ( resid 76 and name HD1 )( resid 76 and name HB# ) 2.9 2.2 1.2
assign ( resid 76 and name HD1 )( resid 76 and name HD2 ) 2.4 2.2 0.7
assign ( resid 76 and name HD2 )( resid 76 and name HG# ) 2.9 2.2 1.2
assign ( resid 76 and name HD2 )( resid 75 and name HA ) 3.6 2.2 2.4
assign ( resid 76 and name HD2 )( resid 76 and name HB# ) 3.6 2.2 2.4
assign ( resid 76 and name HG# )( resid 76 and name HB# ) 3.6 2.2 2.4
assign ( resid 77 and name HA1 )( resid 76 and name HA ) 3.4 2.2 2.2
assign ( resid 77 and name HA1 )( resid 77 and name HA2 ) 2.4 2.2 0.7
assign ( resid 77 and name HA2 )( resid 76 and name HA ) 3.6 2.2 2.4
assign ( resid 77 and name HA2 )( resid 76 and name HB# ) 3.6 2.2 2.4
assign ( resid 77 and name HN )( resid 76 and name HA ) 2.4 2.2 0.7
assign ( resid 77 and name HN )( resid 76 and name HB# ) 3.6 2.2 2.4
assign ( resid 77 and name HN )( resid 76 and name HB# ) 3.6 2.2 2.4
assign ( resid 77 and name HN )( resid 77 and name HA1 ) 2.4 2.2 0.7
assign ( resid 77 and name HN )( resid 77 and name HA2 ) 2.9 2.2 1.2
assign ( resid 77 and name HN )( resid 78 and name HB ) 3.6 2.2 2.4
assign ( resid 78 and name HA )( resid 49 and name HG2 ) 3.6 2.2 2.4
assign ( resid 78 and name HA )( resid 78 and name HB ) 2.9 2.2 1.2
assign ( resid 78 and name HA )( resid 78 and name HG2# ) 3.2 2.2 1.5
assign ( resid 78 and name HA )( resid 79 and name HA ) 3.4 2.2 2.3
assign ( resid 78 and name HB )( resid 51 and name HB# ) 3.6 2.2 2.4
assign ( resid 78 and name HB )( resid 75 and name HN ) 3.4 2.2 2.2
assign ( resid 78 and name HB )( resid 75 and name HA ) 3.4 2.2 2.2
assign ( resid 78 and name HB )( resid 79 and name HN ) 3.4 2.2 2.2
assign ( resid 78 and name HB )( resid 75 and name HG2# ) 3.6 2.2 2.4
assign ( resid 78 and name HG2# )( resid 75 and name HN ) 3.6 2.2 2.4
assign ( resid 78 and name HG2# )( resid 75 and name HG2# ) 3.9 2.2 2.2
assign ( resid 78 and name HG2# )( resid 78 and name HN ) 3.2 2.2 1.5
assign ( resid 78 and name HG2# )( resid 78 and name HB ) 3.2 2.2 1.5
!assign ( resid 78 and name HG2# )( resid 79 and name HA ) 3.4 2.2 2.3
assign ( resid 78 and name HG2# )( resid 49 and name HG2# ) 3.6 2.2 2.4
assign ( resid 78 and name HN )( resid 51 and name HB# ) 3.6 2.2 2.4
assign ( resid 78 and name HN )( resid 77 and name HN ) 2.4 2.2 0.7
assign ( resid 78 and name HN )( resid 77 and name HA1 ) 2.4 2.2 0.7
assign ( resid 78 and name HN )( resid 78 and name HA ) 2.4 2.2 0.7
assign ( resid 78 and name HN )( resid 78 and name HB ) 2.4 2.2 0.7
!assign ( resid 78 and name HN )( resid 79 and name HB1 ) 3.6 2.2 2.4
!assign ( resid 78 and name HN )( resid 79 and name HD2 ) 3.6 2.2 2.4
assign ( resid 79 and name HA )( resid 78 and name HB ) 3.6 2.2 2.4
assign ( resid 79 and name HA )( resid 79 and name HB1 ) 3.6 2.2 2.4
assign ( resid 79 and name HA )( resid 79 and name HB2 ) 3.6 2.2 2.4
assign ( resid 79 and name HA )( resid 79 and name HD# ) 2.9 2.2 1.2
assign ( resid 79 and name HA )( resid 79 and name HG1 ) 3.6 2.2 2.4
!assign ( resid 79 and name HB1 )( resid 48 and name HE1 ) 3.6 2.2 2.4
assign ( resid 79 and name HB1 )( resid 79 and name HD2 ) 3.6 2.2 2.4
assign ( resid 79 and name HB1 )( resid 79 and name HG1 ) 3.6 2.2 2.4
!assign ( resid 79 and name HB2 )( resid 49 and name HB ) 4.2 2.2 2.8
assign ( resid 79 and name HG1 )( resid 79 and name HD# ) 3.4 2.2 2.2
assign ( resid 79 and name HG1 )( resid 79 and name HG1 ) 3.6 2.2 2.4
assign ( resid 79 and name HG1 )( resid 79 and name HB1 ) 3.6 2.2 2.4
assign ( resid 79 and name HG1 )( resid 79 and name HB2 ) 3.6 2.2 2.4
assign ( resid 79 and name HN )( resid 49 and name HG2 ) 3.6 2.2 2.4
assign ( resid 79 and name HN )( resid 78 and name HA ) 3.4 2.2 2.2
assign ( resid 79 and name HN )( resid 78 and name HG2# ) 3.6 2.2 2.4
assign ( resid 79 and name HN )( resid 79 and name HA ) 2.9 2.2 1.2
assign ( resid 79 and name HN )( resid 79 and name HB1 ) 3.6 2.2 2.4
assign ( resid 79 and name HN )( resid 79 and name HD# ) 3.4 2.2 2.2
assign ( resid 79 and name HN )( resid 79 and name HG1 ) 3.6 2.2 2.4
!assign ( resid 79 and name HN )( resid 81 and name HG1# ) 3.6 2.2 2.4
assign ( resid 80 and name HA )( resid 81 and name HG1# ) 3.6 2.2 2.4
assign ( resid 80 and name HA )( resid 81 and name HN ) 2.9 2.2 1.2
assign ( resid 80 and name HB# )( resid 75 and name HD1 ) 3.6 2.2 2.4
assign ( resid 80 and name HB# )( resid 80 and name HA ) 2.9 2.2 1.2
assign ( resid 80 and name HN )( resid 78 and name HG1# ) 3.6 2.2 2.4
assign ( resid 80 and name HN )( resid 79 and name HN ) 3.4 2.2 2.2
assign ( resid 80 and name HN )( resid 79 and name HA ) 3.4 2.2 2.2
assign ( resid 80 and name HN )( resid 79 and name HB1 ) 3.6 2.2 2.4
assign ( resid 80 and name HN )( resid 79 and name HD2 ) 3.6 2.2 2.4
assign ( resid 80 and name HN )( resid 79 and name HG1 ) 3.6 2.2 2.4
assign ( resid 80 and name HN )( resid 80 and name HA ) 2.4 2.2 0.7
!assign ( resid 80 and name HN )( resid 81 and name HA ) 2.9 2.2 1.2
assign ( resid 80 and name HN )( resid 81 and name HG1# ) 3.4 2.2 2.2
!assign ( resid 81 and name HA )( resid 79 and name HD2 ) 3.6 2.2 2.4
assign ( resid 81 and name HA )( resid 81 and name HB ) 3.4 2.2 2.2
assign ( resid 81 and name HA )( resid 81 and name HD1# ) 3.2 2.2 1.5
assign ( resid 81 and name HA )( resid 81 and name HG1# ) 3.6 2.2 2.4
assign ( resid 81 and name HB )( resid 81 and name HD1# ) 2.6 2.2 1.0
assign ( resid 81 and name HB )( resid 81 and name HG2# ) 3.2 2.2 1.5
assign ( resid 81 and name HD1# )( resid 81 and name HG1# ) 3.6 2.2 2.4
assign ( resid 81 and name HD1# )( resid 81 and name HG12 ) 2.6 2.2 1.0
!assign ( resid 81 and name HD1# )( resid 83 and name HB# ) 3.6 2.2 2.4
assign ( resid 81 and name HG1# )( resid 81 and name HB ) 3.6 2.2 2.4
assign ( resid 81 and name HG12 )( resid 81 and name HG13 ) 3.6 2.2 2.4
assign ( resid 81 and name HG12 )( resid 81 and name HG2# ) 2.6 2.2 1.0
assign ( resid 81 and name HG1# )( resid 81 and name HB ) 3.6 2.2 2.4
assign ( resid 81 and name HG1# )( resid 81 and name HG2# ) 3.6 2.2 2.4
assign ( resid 81 and name HG2# )( resid 81 and name HA ) 3.2 2.2 1.5
assign ( resid 81 and name HG2# )( resid 81 and name HD1# ) 3.6 2.2 2.4
assign ( resid 81 and name HN )( resid 80 and name HA ) 2.9 2.2 1.2
assign ( resid 81 and name HN )( resid 80 and name HB# ) 3.6 2.2 2.4
assign ( resid 81 and name HN )( resid 81 and name HA ) 2.9 2.2 1.2
assign ( resid 81 and name HN )( resid 81 and name HB ) 2.9 2.2 1.2
assign ( resid 81 and name HN )( resid 81 and name HD1# ) 2.6 2.2 1.0
assign ( resid 81 and name HN )( resid 81 and name HG2# ) 3.6 2.2 2.4
assign ( resid 81 and name HN )( resid 82 and name HB2 ) 3.6 2.2 2.4
assign ( resid 82 and name HA )( resid 81 and name HG2# ) 3.6 2.2 2.4
assign ( resid 82 and name HA )( resid 82 and name HB2 ) 3.4 2.2 2.2
assign ( resid 82 and name HB2 )( resid 82 and name HE# ) 4.0 2.0 2.2
!assign ( resid 82 and name HD# )( resid 16 and name HB# ) 3.4 2.2 2.2
assign ( resid 82 and name HD# )( resid 82 and name HA ) 3.4 2.2 2.2
assign ( resid 82 and name HD# )( resid 82 and name HB2 ) 3.4 2.2 2.2
assign ( resid 82 and name HE# )( resid 82 and name HZ ) 3.6 2.2 2.4
assign ( resid 82 and name HN  )( resid 81 and name HN  ) 3.6 2.2 2.4
assign ( resid 82 and name HN  )( resid 81 and name HA ) 2.4 2.2 0.7
assign ( resid 82 and name HN  )( resid 81 and name HB ) 3.4 2.2 2.2
assign ( resid 82 and name HN  )( resid 81 and name HD1# ) 3.6 2.2 2.4
assign ( resid 82 and name HN  )( resid 81 and name HG2# ) 3.2 2.2 1.5
assign ( resid 82 and name HN  )( resid 82 and name HA ) 3.4 2.2 2.2
assign ( resid 82 and name HN  )( resid 82 and name HB2 ) 2.9 2.2 1.2
assign ( resid 82 and name HN  )( resid 82 and name HD# ) 3.4 2.2 2.2
assign ( resid 83 and name HB# )( resid 13 and name HE# ) 3.4 2.2 2.2
assign ( resid 83 and name HB# )( resid 83 and name HA ) 3.4 2.2 2.2
assign ( resid 83 and name HN )( resid 82 and name HA ) 3.6 2.2 2.4
assign ( resid 83 and name HN )( resid 83 and name HA ) 2.9 2.2 1.2
assign ( resid 83 and name HN )( resid 83 and name HB# ) 3.2 2.2 1.5
assign ( resid 83 and name HN )( resid 84 and name HA1 ) 3.6 2.2 2.4
assign ( resid 84 and name HA1 )( resid 83 and name HB# ) 3.6 2.2 2.4
assign ( resid 84 and name HA1 )( resid 84 and name HA2 ) 2.9 2.2 1.2
assign ( resid 84 and name HA1 )( resid 85 and name HA ) 3.6 2.2 2.4
assign ( resid 84 and name HA1 )( resid 85 and name HB ) 3.6 2.2 2.4
assign ( resid 84 and name HA2 )( resid 85 and name HB ) 3.6 2.2 2.4
assign ( resid 84 and name HN )( resid 84 and name HA1 ) 2.9 2.2 1.2
assign ( resid 84 and name HN )( resid 84 and name HA2 ) 3.2 2.2 1.5
assign ( resid 85 and name HA )( resid 84 and name HA2 ) 3.6 2.2 2.4
assign ( resid 85 and name HA )( resid 85 and name HB ) 3.4 2.2 2.2
assign ( resid 85 and name HA )( resid 85 and name HD1# ) 3.2 2.2 1.5
assign ( resid 85 and name HA )( resid 85 and name HG1# ) 3.4 2.2 2.2
assign ( resid 85 and name HA )( resid 85 and name HG1# ) 3.4 2.2 2.2
assign ( resid 85 and name HA )( resid 85 and name HG2# ) 3.2 2.2 1.5
assign ( resid 85 and name HA )( resid 87 and name HN ) 2.9 2.2 1.2
assign ( resid 85 and name HB )( resid 85 and name HG1# ) 3.4 2.2 2.2
assign ( resid 85 and name HB )( resid 85 and name HG2# ) 3.2 2.2 1.5
assign ( resid 85 and name HB )( resid 87 and name HN ) 3.4 2.2 2.2
!assign ( resid 85 and name HD1# )( resid 9 and name HB ) 3.6 2.2 2.4
assign ( resid 85 and name HD1# )( resid 85 and name HB ) 3.6 2.2 2.4
assign ( resid 85 and name HD1# )( resid 85 and name HG1# ) 3.6 2.2 2.4
assign ( resid 85 and name HD1# )( resid 85 and name HG2# ) 3.4 2.2 2.2
assign ( resid 85 and name HD1# )( resid 90 and name HG# ) 3.4 2.2 2.2
assign ( resid 85 and name HD1# )( resid 91 and name HN ) 3.6 2.2 2.4
assign ( resid 85 and name HG12 )( resid 85 and name HG13 ) 3.2 2.2 1.5
assign ( resid 85 and name HG1# )( resid 85 and name HG2# ) 3.6 2.2 2.4
assign ( resid 85 and name HG1# )( resid 9 and name HD1# ) 3.6 2.2 2.4
assign ( resid 85 and name HG1# )( resid 85 and name HG2# ) 3.6 2.2 2.4
assign ( resid 85 and name HG2# )( resid 90 and name HB# ) 3.4 2.2 2.2
assign ( resid 85 and name HG2# )( resid 86 and name HB# ) 3.6 2.2 2.4
!assign ( resid 85 and name HG2# )( resid 90 and name HB# ) 3.6 2.2 2.4
!assign ( resid 85 and name HN )( resid 84 and name HA1 ) 2.4 2.2 0.7
assign ( resid 85 and name HN )( resid 84 and name HA2 ) 2.4 2.2 0.7
assign ( resid 85 and name HN )( resid 85 and name HA ) 2.4 2.2 0.7
assign ( resid 85 and name HN )( resid 85 and name HB ) 3.4 2.2 2.2
assign ( resid 85 and name HN )( resid 85 and name HD1# ) 3.6 2.2 2.4
assign ( resid 85 and name HN )( resid 85 and name HG2# ) 3.4 1.5 1.5
assign ( resid 85 and name HN )( resid 86 and name HN ) 3.4 2.2 2.2
assign ( resid 85 and name HN )( resid 86 and name HB# ) 3.4 2.2 2.2
assign ( resid 85 and name HN )( resid 86 and name HG# ) 3.4 2.2 2.2
!assign ( resid 85 and name HN )( resid 87 and name HA ) 3.6 2.2 2.4
!assign ( resid 86 and name HA )( resid 69 and name HG# ) 3.6 2.2 2.4
assign ( resid 86 and name HA )( resid 86 and name HB# ) 2.9 2.2 1.2
assign ( resid 86 and name HA )( resid 86 and name HD2 ) 3.4 2.2 2.2
assign ( resid 86 and name HA )( resid 86 and name HG# ) 3.4 2.2 2.2
assign ( resid 86 and name HA )( resid 87 and name HB1 ) 3.6 2.2 2.4
assign ( resid 86 and name HB# )( resid 86 and name HD2 ) 3.4 2.2 2.2
assign ( resid 86 and name HB# )( resid 86 and name HG# ) 3.4 2.2 2.2
assign ( resid 86 and name HG# )( resid 86 and name HD2 ) 3.4 2.2 2.2
!assign ( resid 86 and name HN  )( resid 65 and name HG1 ) 3.6 2.2 2.4
assign ( resid 86 and name HN  )( resid 85 and name HA ) 2.9 2.2 1.2
assign ( resid 86 and name HN  )( resid 85 and name HG2# ) 3.6 2.2 2.4
assign ( resid 86 and name HN  )( resid 86 and name HA ) 2.9 2.2 1.2
assign ( resid 86 and name HN  )( resid 86 and name HB# ) 2.9 2.2 1.2
assign ( resid 86 and name HN  )( resid 86 and name HD2 ) 3.6 2.2 2.4
assign ( resid 86 and name HN  )( resid 86 and name HG# ) 3.4 2.2 2.2
assign ( resid 86 and name HN  )( resid 87 and name HN  ) 2.4 2.2 0.7
assign ( resid 87 and name HA )( resid 86 and name HB# ) 3.6 2.2 2.4
!assign ( resid 87 and name HA )( resid 86 and name HG# ) 3.6 2.2 2.4
assign ( resid 87 and name HA )( resid 87 and name HB1 ) 3.6 2.2 2.4
assign ( resid 87 and name HA )( resid 87 and name HD2 ) 3.6 2.2 2.4
assign ( resid 87 and name HA )( resid 87 and name HG2 ) 3.6 2.2 2.4
!assign ( resid 87 and name HA )( resid 91 and name HD# ) 3.6 2.2 2.4
assign ( resid 87 and name HB1 )( resid 86 and name HG# ) 3.6 2.2 2.4
assign ( resid 87 and name HB1 )( resid 87 and name HD2 ) 3.6 2.2 2.4
assign ( resid 87 and name HB1 )( resid 87 and name HG2 ) 3.6 2.2 2.4
assign ( resid 87 and name HD2 )( resid 86 and name HB# ) 3.6 2.2 2.4
assign ( resid 87 and name HD2 )( resid 87 and name HG2 ) 3.6 2.2 2.4
assign ( resid 87 and name HN  )( resid 85 and name HG2# ) 3.2 2.2 1.5
assign ( resid 87 and name HN  )( resid 86 and name HA ) 3.4 2.2 2.2
assign ( resid 87 and name HN  )( resid 86 and name HB ) 2.6 2.2 1.0
assign ( resid 87 and name HN  )( resid 86 and name HG# ) 3.4 2.2 2.2
assign ( resid 87 and name HN  )( resid 87 and name HA ) 2.4 2.2 0.7
assign ( resid 87 and name HN  )( resid 87 and name HB1 ) 3.6 2.2 2.4
assign ( resid 87 and name HN  )( resid 87 and name HD2 ) 3.4 2.2 2.2
assign ( resid 87 and name HN  )( resid 87 and name HG# ) 2.9 2.2 1.2
assign ( resid 87 and name HN  )( resid 88 and name HA ) 3.6 2.2 2.4
!assign ( resid 87 and name HN  )( resid 88 and name HB# ) 3.6 2.2 2.4
assign ( resid 88 and name HA )( resid 88 and name HB# ) 2.9 2.2 1.2
assign ( resid 88 and name HA )( resid 88 and name HD2 ) 3.6 2.2 2.4
assign ( resid 88 and name HA )( resid 88 and name HG# ) 3.4 2.2 2.2
assign ( resid 88 and name HA )( resid 89 and name HG2 ) 3.6 2.2 2.4
assign ( resid 88 and name HG# )( resid 88 and name HB# ) 3.6 2.2 2.4
assign ( resid 88 and name HG# )( resid 88 and name HD2 ) 3.6 2.2 2.4
assign ( resid 88 and name HG# )( resid 89 and name HN ) 3.6 2.2 2.4
assign ( resid 88 and name HG# )( resid 89 and name HB ) 3.6 2.2 2.4
assign ( resid 88 and name HN )( resid 87 and name HN ) 3.4 2.2 2.2
assign ( resid 88 and name HN )( resid 88 and name HA ) 3.4 2.2 2.2
assign ( resid 88 and name HN )( resid 88 and name HB# ) 3.4 2.2 2.2
assign ( resid 88 and name HN )( resid 89 and name HG2 ) 3.6 2.2 2.4
assign ( resid 89 and name HA )( resid 88 and name HB# ) 3.6 2.2 2.4
assign ( resid 89 and name HA )( resid 89 and name HG2 ) 3.2 2.2 1.5
assign ( resid 89 and name HA )( resid 90 and name HG# ) 3.6 2.2 2.4
assign ( resid 89 and name HB )( resid 88 and name HB# ) 3.6 2.2 2.4
assign ( resid 89 and name HB )( resid 89 and name HA ) 3.6 2.2 2.4
assign ( resid 89 and name HB )( resid 89 and name HG2 ) 2.6 2.2 1.0
assign ( resid 89 and name HB )( resid 90 and name HN ) 3.6 2.2 2.4
assign ( resid 89 and name HB )( resid 90 and name HG# ) 3.4 2.2 2.2
assign ( resid 89 and name HB )( resid 92 and name HB# ) 3.6 2.2 2.4
assign ( resid 89 and name HG2 )( resid 88 and name HB# ) 3.4 2.2 2.2
assign ( resid 89 and name HN )( resid 88 and name HN ) 3.6 2.2 2.4
assign ( resid 89 and name HN )( resid 88 and name HA ) 3.6 2.2 2.4
assign ( resid 89 and name HN )( resid 88 and name HB# ) 3.6 2.2 2.4
assign ( resid 89 and name HN )( resid 89 and name HA ) 2.4 2.2 0.7
assign ( resid 89 and name HN )( resid 89 and name HB ) 2.9 2.2 1.2
assign ( resid 89 and name HN )( resid 89 and name HG2 ) 2.6 2.2 1.0
assign ( resid 89 and name HN )( resid 90 and name HG# ) 3.6 2.2 2.4
assign ( resid 90 and name HA )( resid 93 and name HB# ) 3.6 2.2 2.4
!assign ( resid 90 and name HA )( resid 94 and name HA2 ) 3.6 2.2 2.4
assign ( resid 90 and name HB# )( resid 90 and name HA ) 3.6 2.2 2.4
assign ( resid 90 and name HB# )( resid 90 and name HG# ) 3.6 2.2 2.4
assign ( resid 90 and name HB# )( resid 91 and name HA ) 3.6 2.2 2.4
!assign ( resid 90 and name HB# )( resid 9 and name HD1# ) 4.0 2.0 2.7 
!assign ( resid 90 and name HB# )( resid 88 and name HA ) 3.6 2.2 2.4
assign ( resid 90 and name HB# )( resid 90 and name HA ) 3.6 2.2 2.4
!assign ( resid 90 and name HB# )( resid 9 and name HD1# ) 4.0 2.0 2.7 
assign ( resid 90 and name HG# )( resid 85 and name HG2# ) 3.4 2.2 2.2
assign ( resid 90 and name HG# )( resid 89 and name HG2 ) 3.6 2.2 2.4
assign ( resid 90 and name HG# )( resid 90 and name HA ) 3.6 2.2 2.4
assign ( resid 90 and name HG# )( resid 90 and name HB# ) 3.6 2.2 2.4
!assign ( resid 90 and name HG# )( resid 9 and name HD1# ) 3.0 1.2 1.2
assign ( resid 90 and name HN )( resid 85 and name HG2# ) 3.4 2.2 2.2
assign ( resid 90 and name HN )( resid 89 and name HN ) 2.9 2.2 1.2
assign ( resid 90 and name HN )( resid 89 and name HB ) 2.9 2.2 1.2
assign ( resid 90 and name HN )( resid 89 and name HG2 ) 3.6 2.2 2.4
assign ( resid 90 and name HN )( resid 90 and name HA ) 2.4 2.2 0.7
assign ( resid 90 and name HN )( resid 90 and name HB# ) 2.4 2.2 0.7
assign ( resid 90 and name HN )( resid 90 and name HG# ) 2.9 2.2 1.2
assign ( resid 90 and name HN )( resid 91 and name HB# ) 3.6 2.2 2.4
assign ( resid 90 and name HN )( resid 91 and name HG# ) 3.6 2.2 2.4
assign ( resid 90 and name HN )( resid 92 and name HB# ) 3.6 2.2 2.4
!assign ( resid 91 and name HA )( resid 85 and name HD1# ) 3.6 2.2 2.4
assign ( resid 91 and name HA )( resid 91 and name HB# ) 2.9 2.2 1.2
assign ( resid 91 and name HA )( resid 91 and name HD# ) 3.4 2.2 2.2
assign ( resid 91 and name HA )( resid 91 and name HG# ) 2.4 2.2 0.7
assign ( resid 91 and name HA )( resid 92 and name HN ) 3.4 2.2 2.2
assign ( resid 91 and name HA )( resid 93 and name HN ) 3.4 2.2 2.2
assign ( resid 91 and name HB# )( resid 91 and name HD# ) 3.4 2.2 2.2
assign ( resid 91 and name HB# )( resid 91 and name HG# ) 2.9 2.2 1.2
assign ( resid 91 and name HD# )( resid 91 and name HG# ) 2.9 2.2 1.2
assign ( resid 91 and name HD# )( resid 91 and name HN ) 3.4 2.2 2.2
assign ( resid 91 and name HG# )( resid 91 and name HD# ) 2.9 2.2 1.2
assign ( resid 91 and name HN )( resid 85 and name HD1# ) 3.6 2.2 2.4
assign ( resid 91 and name HN )( resid 85 and name HG2# ) 3.6 2.2 2.4
assign ( resid 91 and name HN )( resid 89 and name HG2 ) 3.6 2.2 2.4
assign ( resid 91 and name HN )( resid 90 and name HN ) 2.9 2.2 1.2
assign ( resid 91 and name HN )( resid 90 and name HA ) 3.6 2.2 2.4
assign ( resid 91 and name HN )( resid 90 and name HG# ) 3.6 2.2 2.4
assign ( resid 91 and name HN )( resid 91 and name HA ) 2.4 2.2 0.7
assign ( resid 91 and name HN )( resid 91 and name HB# ) 2.9 2.2 1.2
assign ( resid 91 and name HN )( resid 91 and name HG# ) 2.9 2.2 1.2
assign ( resid 91 and name HN )( resid 92 and name HN ) 2.9 2.2 1.2
assign ( resid 91 and name HN )( resid 92 and name HB# ) 3.6 2.2 2.4
assign ( resid 92 and name HA )( resid 92 and name HB# ) 3.4 2.2 2.2
assign ( resid 92 and name HA )( resid 95 and name HD1# ) 3.6 2.2 2.4
assign ( resid 92 and name HA )( resid 95 and name HG1# ) 3.6 2.2 2.4
assign ( resid 92 and name HA )( resid 95 and name HG2# ) 3.4 2.2 2.2
assign ( resid 92 and name HB# )( resid 89 and name HA ) 3.6 2.2 2.4
assign ( resid 92 and name HB# )( resid 89 and name HG2 ) 3.6 2.2 2.4
assign ( resid 92 and name HB# )( resid 92 and name HG# ) 3.4 2.2 2.2
assign ( resid 92 and name HB# )( resid 95 and name HD1# ) 3.6 2.2 2.4
assign ( resid 92 and name HB# )( resid 89 and name HN ) 3.6 2.2 2.4
assign ( resid 92 and name HB# )( resid 92 and name HG# ) 3.4 2.2 2.2
assign ( resid 92 and name HG# )( resid 92 and name HA ) 3.4 2.2 2.2
assign ( resid 92 and name HN )( resid 90 and name HA ) 3.6 2.2 2.4
assign ( resid 92 and name HN )( resid 90 and name HN ) 2.9 2.2 1.2
assign ( resid 92 and name HN )( resid 91 and name HA ) 3.4 2.2 2.2
assign ( resid 92 and name HN )( resid 91 and name HB# ) 3.6 2.2 2.4
assign ( resid 92 and name HN )( resid 91 and name HG# ) 3.6 2.2 2.4
assign ( resid 92 and name HN )( resid 92 and name HA ) 2.9 2.2 1.2
assign ( resid 92 and name HN )( resid 92 and name HB# ) 2.9 2.2 1.2
assign ( resid 92 and name HN )( resid 92 and name HG# ) 3.4 2.2 2.2
assign ( resid 92 and name HN )( resid 93 and name HN ) 2.9 2.2 1.2
assign ( resid 92 and name HN )( resid 93 and name HB# ) 3.6 2.2 2.4
assign ( resid 92 and name HN )( resid 95 and name HD1# ) 3.6 2.2 2.4
assign ( resid 92 and name HN )( resid 95 and name HG1# ) 3.6 2.2 2.4
assign ( resid 93 and name HA )( resid 93 and name HB# ) 3.2 2.2 1.5
assign ( resid 93 and name HA )( resid 94 and name HA2 ) 3.4 2.2 2.2
assign ( resid 93 and name HB# )( resid 96 and name HB ) 3.4 2.2 2.2
assign ( resid 93 and name HB# )( resid 93 and name HA ) 2.9 2.2 1.2
!assign ( resid 93 and name HN )( resid 9 and name HD1# ) 3.6 2.2 2.4
assign ( resid 93 and name HN )( resid 89 and name HA ) 3.6 2.2 2.4
assign ( resid 93 and name HN )( resid 89 and name HG2 ) 3.6 2.2 2.4
assign ( resid 93 and name HN )( resid 90 and name HA ) 2.9 2.2 1.2
assign ( resid 93 and name HN )( resid 91 and name HN ) 3.4 2.2 2.2
assign ( resid 93 and name HN )( resid 91 and name HA ) 3.4 2.2 2.2
assign ( resid 93 and name HN )( resid 91 and name HB# ) 3.6 2.2 2.4
assign ( resid 93 and name HN )( resid 92 and name HA ) 3.4 2.2 2.2
assign ( resid 93 and name HN )( resid 92 and name HB# ) 3.4 2.2 2.2
assign ( resid 93 and name HN )( resid 92 and name HG# ) 3.4 2.2 2.2
assign ( resid 93 and name HN )( resid 93 and name HA ) 2.4 2.2 0.7
assign ( resid 93 and name HN )( resid 93 and name HB# ) 2.9 2.2 1.2
assign ( resid 93 and name HN )( resid 94 and name HA1 ) 3.4 2.2 2.2
!assign ( resid 93 and name HN )( resid 9 and name HD1# ) 3.6 2.2 2.4
assign ( resid 94 and name HA2 )( resid 93 and name HN ) 3.4 2.2 2.2
assign ( resid 94 and name HA2 )( resid 94 and name HA1 ) 2.9 2.2 1.2
assign ( resid 94 and name HA2 )( resid 95 and name HN ) 3.6 2.2 2.4
assign ( resid 94 and name HN )( resid 91 and name HA ) 3.4 2.2 2.2
assign ( resid 94 and name HN )( resid 91 and name HB# ) 3.6 2.2 2.4
assign ( resid 94 and name HN )( resid 92 and name HB# ) 3.6 2.2 2.4
assign ( resid 94 and name HN )( resid 93 and name HN ) 2.4 2.2 0.7
assign ( resid 94 and name HN )( resid 93 and name HB# ) 3.4 2.2 2.2
assign ( resid 94 and name HN )( resid 94 and name HA1 ) 2.4 2.2 0.7
assign ( resid 94 and name HN )( resid 94 and name HA2 ) 2.9 2.2 1.2
assign ( resid 94 and name HN )( resid 95 and name HN ) 2.9 2.2 1.2
assign ( resid 95 and name HA )( resid 94 and name HA2 ) 3.6 2.2 2.4
assign ( resid 95 and name HA )( resid 95 and name HB ) 3.4 2.2 2.2
assign ( resid 95 and name HA )( resid 95 and name HD1# ) 3.2 2.2 1.5
assign ( resid 95 and name HA )( resid 95 and name HG1# ) 3.6 2.2 2.4
assign ( resid 95 and name HA )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 95 and name HA )( resid 98 and name HD1# ) 3.6 2.2 2.4
assign ( resid 95 and name HA )( resid 99 and name HN ) 3.6 2.2 2.4
assign ( resid 95 and name HB )( resid 92 and name HA ) 3.6 2.2 2.4
assign ( resid 95 and name HB )( resid 95 and name HD1# ) 3.4 2.2 2.2
assign ( resid 95 and name HB )( resid 95 and name HG1# ) 3.4 2.2 2.2
assign ( resid 95 and name HB )( resid 96 and name HB# ) 3.6 2.2 2.4
assign ( resid 95 and name HD1# )( resid 65 and name HG2 ) 3.6 2.2 2.4
assign ( resid 95 and name HD1# )( resid 95 and name HG1# ) 3.6 2.2 2.4
assign ( resid 95 and name HG1# )( resid 92 and name HA ) 3.6 2.2 2.4
assign ( resid 95 and name HG1# )( resid 95 and name HG2# ) 3.4 2.2 2.2
assign ( resid 95 and name HG2# )( resid 36 and name HE# ) 3.6 2.2 2.4
assign ( resid 95 and name HG2# )( resid 36 and name HZ ) 3.6 2.2 2.4
assign ( resid 95 and name HG2# )( resid 61 and name HG# ) 3.6 2.2 2.4
assign ( resid 95 and name HG2# )( resid 64 and name HD1# ) 3.9 2.2 2.2
assign ( resid 95 and name HG2# )( resid 95 and name HB ) 3.4 2.2 2.2
assign ( resid 95 and name HG2# )( resid 95 and name HD1# ) 3.4 2.2 2.2
assign ( resid 95 and name HN )( resid 92 and name HA ) 3.6 2.2 2.4
assign ( resid 95 and name HN )( resid 94 and name HA1 ) 2.9 2.2 1.2
assign ( resid 95 and name HN )( resid 95 and name HA ) 2.9 2.2 1.2
assign ( resid 95 and name HN )( resid 95 and name HB ) 2.4 2.2 0.7
assign ( resid 95 and name HN )( resid 95 and name HD1# ) 3.2 2.2 1.5
assign ( resid 95 and name HN )( resid 95 and name HG2# ) 3.2 2.2 1.5
assign ( resid 95 and name HN )( resid 96 and name HN ) 2.9 2.2 1.2
!assign ( resid 95 and name HN )( resid 96 and name HA ) 3.2 2.2 1.5
assign ( resid 95 and name HN )( resid 96 and name HB# ) 3.4 2.2 2.2
!assign ( resid 95 and name HN )( resid 98 and name HB# ) 3.6 2.2 2.4
assign ( resid 95 and name HN )( resid 98 and name HD1# ) 3.6 2.2 2.4
assign ( resid 96 and name HA )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 96 and name HB# )( resid 93 and name HA ) 3.6 2.2 2.4
assign ( resid 96 and name HB# )( resid 96 and name HA ) 3.6 2.2 2.4
assign ( resid 96 and name HN )( resid 92 and name HA ) 3.6 2.2 2.4
assign ( resid 96 and name HN )( resid 93 and name HA ) 3.6 2.2 2.4
assign ( resid 96 and name HN )( resid 93 and name HB# ) 3.6 2.2 2.4
assign ( resid 96 and name HN )( resid 95 and name HA ) 2.9 2.2 1.2
assign ( resid 96 and name HN )( resid 95 and name HB ) 2.9 2.2 1.2
assign ( resid 96 and name HN )( resid 95 and name HG1# ) 3.6 2.2 2.4
assign ( resid 96 and name HN )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 96 and name HN )( resid 96 and name HA ) 2.4 2.2 0.7
assign ( resid 96 and name HN )( resid 96 and name HB# ) 3.2 2.2 1.5
assign ( resid 96 and name HN )( resid 98 and name HN ) 3.4 2.2 2.2
assign ( resid 96 and name HN )( resid 99 and name HD# ) 3.6 2.2 2.4
assign ( resid 97 and name HA )( resid 3 and name HG1# ) 3.6 2.2 2.4
assign ( resid 97 and name HA )( resid 3 and name HG2# ) 3.6 2.2 2.4
!assign ( resid 97 and name HA )( resid 6 and name HA2 ) 3.6 2.2 2.4
assign ( resid 97 and name HA )( resid 97 and name HB1 ) 2.4 2.2 0.7
assign ( resid 97 and name HA )( resid 97 and name HB2 ) 2.4 2.2 0.7
assign ( resid 97 and name HA )( resid 97 and name HD1 ) 3.4 2.2 2.2
assign ( resid 97 and name HB1 )( resid 3 and name HG2# ) 4.2 2.2 2.7
!assign ( resid 97 and name HB1 )( resid 7 and name HD# ) 3.6 2.2 2.4
assign ( resid 97 and name HB1 )( resid 94 and name HA1 ) 3.6 2.2 2.4
assign ( resid 97 and name HB1 )( resid 98 and name HA ) 3.6 2.2 2.4
assign ( resid 97 and name HB2 )( resid 96 and name HN ) 3.4 2.2 2.2
assign ( resid 97 and name HB2 )( resid 97 and name HN ) 2.4 2.2 0.7
assign ( resid 97 and name HB2 )( resid 97 and name HB1 ) 2.9 2.2 1.2
assign ( resid 97 and name HB2 )( resid 97 and name HD1 ) 3.6 2.2 2.4
assign ( resid 97 and name HB2 )( resid 97 and name HD2 ) 3.6 2.2 2.4
assign ( resid 97 and name HB2 )( resid 98 and name HN ) 3.6 2.2 2.4
assign ( resid 97 and name HD1 )( resid 3 and name HG2# ) 3.6 2.2 2.4
assign ( resid 97 and name HD1 )( resid 7 and name HB# ) 3.6 2.2 2.4
assign ( resid 97 and name HD1 )( resid 97 and name HA ) 3.4 2.2 2.2
!assign ( resid 97 and name HD2 )( resid 7 and name HG# ) 3.4 2.2 2.2
assign ( resid 97 and name HD2 )( resid 3 and name HG1# ) 3.9 2.2 2.2
assign ( resid 97 and name HD2 )( resid 3 and name HG2# ) 3.9 2.2 2.2
assign ( resid 97 and name HD2 )( resid 97 and name HA ) 3.4 2.2 2.2
assign ( resid 97 and name HD2 )( resid 97 and name HB1 ) 2.9 2.2 1.2
assign ( resid 97 and name HD2 )( resid 97 and name HD1 ) 3.6 2.2 2.4
assign ( resid 97 and name HE1 )( resid 7 and name HB# ) 3.6 2.2 2.4
assign ( resid 97 and name HE2 )( resid 3 and name HG1# ) 3.6 2.2 2.4
assign ( resid 97 and name HE2 )( resid 3 and name HG2# ) 3.6 2.2 2.4
assign ( resid 97 and name HN )( resid 3 and name HG2# ) 3.6 2.2 2.4
assign ( resid 97 and name HN )( resid 95 and name HB ) 3.4 2.2 2.2
assign ( resid 97 and name HN )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 97 and name HN )( resid 96 and name HA ) 2.9 2.2 1.2
assign ( resid 97 and name HN )( resid 96 and name HB# ) 2.6 2.2 1.0
assign ( resid 97 and name HN )( resid 97 and name HA ) 2.4 2.2 0.7
assign ( resid 97 and name HN )( resid 97 and name HB1 ) 2.9 2.2 1.2
assign ( resid 97 and name HN )( resid 99 and name HN ) 3.4 2.2 2.2
assign ( resid 98 and name HA )( resid 97 and name HA ) 3.4 2.2 2.2
assign ( resid 98 and name HA )( resid 98 and name HB# ) 3.4 2.2 2.2
assign ( resid 98 and name HA )( resid 98 and name HD1# ) 3.6 2.2 2.4
assign ( resid 98 and name HA )( resid 98 and name HG ) 3.6 2.2 2.4
assign ( resid 98 and name HA )( resid 102 and name HG2# ) 3.2 2.2 1.5
assign ( resid 98 and name HB# )( resid 98 and name HD1# ) 3.4 2.2 2.2
assign ( resid 98 and name HB# )( resid 98 and name HD2# ) 3.4 2.2 2.2
assign ( resid 98 and name HB# )( resid 98 and name HG ) 2.9 2.2 1.2
assign ( resid 98 and name HB# )( resid 35 and name HD1 ) 3.6 2.2 2.4
assign ( resid 98 and name HB# )( resid 36 and name HE# ) 3.9 2.2 2.2
assign ( resid 98 and name HB# )( resid 36 and name HZ ) 3.9 2.2 2.2
assign ( resid 98 and name HB# )( resid 95 and name HD1# ) 4.2 2.2 2.2
assign ( resid 98 and name HD1# )( resid 95 and name HD1# ) 3.6 2.2 2.4
assign ( resid 98 and name HD1# )( resid 98 and name HD2# ) 3.4 2.2 2.2
assign ( resid 98 and name HD1# )( resid 98 and name HG ) 2.6 2.2 1.0
assign ( resid 98 and name HD1# )( resid 35 and name HD2#) 3.9 2.2 2.2
assign ( resid 98 and name HD2# )( resid 35 and name HD1#) 3.9 2.2 2.2
assign ( resid 98 and name HD2# )( resid 98 and name HA ) 2.9 2.2 1.2
assign ( resid 98 and name HD2# )( resid 98 and name HG ) 2.6 2.2 1.0
assign ( resid 98 and name HN )( resid 101 and name HN ) 3.6 2.2 2.4
assign ( resid 98 and name HN )( resid 95 and name HA ) 3.4 2.2 2.2
assign ( resid 98 and name HN )( resid 95 and name HB ) 3.6 2.2 2.4
assign ( resid 98 and name HN )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 98 and name HN )( resid 97 and name HN ) 2.9 2.2 1.2
assign ( resid 98 and name HN )( resid 97 and name HA ) 3.6 2.2 2.4
assign ( resid 98 and name HN )( resid 97 and name HB1 ) 3.6 2.2 2.4
assign ( resid 98 and name HN )( resid 97 and name HD1 ) 3.6 2.2 2.4
assign ( resid 98 and name HN )( resid 97 and name HD2 ) 3.4 2.2 2.2
assign ( resid 98 and name HN )( resid 98 and name HA ) 2.9 2.2 1.2
assign ( resid 98 and name HN )( resid 98 and name HB# ) 2.4 2.2 0.7
assign ( resid 98 and name HN )( resid 98 and name HD1 ) 3.2 2.2 1.5
assign ( resid 98 and name HN )( resid 98 and name HD2# ) 3.6 2.2 2.4
assign ( resid 98 and name HN )( resid 98 and name HG ) 3.2 2.2 1.5
assign ( resid 99 and name HA )( resid 102 and name HN ) 2.9 2.2 1.2
assign ( resid 99 and name HA )( resid 36 and name HE# ) 3.4 2.2 2.2
assign ( resid 99 and name HA )( resid 99 and name HB# ) 3.4 2.2 2.2
assign ( resid 99 and name HA )( resid 99 and name HD# ) 3.4 2.2 2.2
assign ( resid 99 and name HA )( resid 99 and name HG# ) 2.9 2.2 1.2
assign ( resid 99 and name HE# )( resid 99 and name HA ) 3.4 2.2 2.2
assign ( resid 99 and name HE# )( resid 99 and name HB# ) 3.6 2.2 2.4
assign ( resid 99 and name HE# )( resid 100 and name HN ) 3.4 2.2 2.2
assign ( resid 99 and name HN )( resid 101 and name HB# ) 3.6 2.2 2.4
assign ( resid 99 and name HN )( resid 95 and name HG2# ) 3.6 2.2 2.4
assign ( resid 99 and name HN )( resid 96 and name HA ) 2.9 2.2 1.2
assign ( resid 99 and name HN )( resid 98 and name HN ) 3.4 2.2 2.2
assign ( resid 99 and name HN )( resid 98 and name HB# ) 3.6 2.2 2.4
assign ( resid 99 and name HN )( resid 99 and name HA ) 2.9 2.2 1.2
assign ( resid 99 and name HN )( resid 99 and name HB# ) 2.9 2.2 1.2
assign ( resid 99 and name HN )( resid 99 and name HD# ) 3.4 2.2 2.2
assign ( resid 99 and name HN )( resid 99 and name HE# ) 3.6 2.2 2.4
assign ( resid 99 and name HN )( resid 99 and name HG# ) 2.9 2.2 1.2
assign ( resid 99 and name HN )( resid 100 and name HN ) 2.4 2.2 0.7
assign ( resid 100 and name HA )( resid 100 and name HD# ) 3.6 2.2 2.4
assign ( resid 100 and name HB# )( resid 100 and name HA ) 2.4 2.2 0.7
assign ( resid 100 and name HB# )( resid 100 and name HG# ) 3.4 2.2 2.2
assign ( resid 100 and name HD# )( resid 100 and name HB# ) 3.6 2.2 2.4
assign ( resid 100 and name HG# )( resid 100 and name HA ) 3.4 2.2 2.2
assign ( resid 100 and name HG# )( resid 100 and name HD# ) 3.6 2.2 2.4
assign ( resid 100 and name HN )( resid 100 and name HA ) 2.4 2.2 0.7
assign ( resid 100 and name HN )( resid 100 and name HB# ) 2.4 2.2 0.7
assign ( resid 100 and name HN )( resid 100 and name HD# ) 3.6 2.2 2.4
assign ( resid 100 and name HN )( resid 101 and name HB# ) 3.6 2.2 2.4
assign ( resid 100 and name HN )( resid 98 and name HN ) 3.4 2.2 2.2
assign ( resid 100 and name HN )( resid 98 and name HA ) 3.4 2.2 2.2
assign ( resid 100 and name HN )( resid 99 and name HN ) 2.4 2.2 0.7
assign ( resid 100 and name HN )( resid 99 and name HA ) 2.9 2.2 1.2
assign ( resid 100 and name HN )( resid 99 and name HB# ) 2.4 2.2 0.7
assign ( resid 100 and name HN )( resid 103 and name HN ) 3.4 2.2 2.2
assign ( resid 101 and name HA )( resid 102 and name HG2# ) 3.6 2.2 2.4
!assign ( resid 101 and name HA )( resid 3 and name HG1# ) 3.6 2.2 2.4
!assign ( resid 101 and name HA )( resid 3 and name HG2# ) 3.6 2.2 2.4
assign ( resid 101 and name HB# )( resid 100 and name HB# ) 3.6 2.2 2.4
assign ( resid 101 and name HB# )( resid 101 and name HA ) 2.6 2.2 1.0
assign ( resid 101 and name HB# )( resid 97 and name HB1 ) 3.6 2.2 2.4
assign ( resid 101 and name HB# )( resid 98 and name HA ) 3.6 2.2 2.4
assign ( resid 101 and name HN )( resid 3 and name HG2# ) 3.6 2.2 2.4
assign ( resid 101 and name HN )( resid 100 and name HN ) 2.4 2.2 0.7
assign ( resid 101 and name HN )( resid 100 and name HB# ) 2.9 2.2 1.2
assign ( resid 101 and name HN )( resid 100 and name HD# ) 3.4 2.2 2.2
assign ( resid 101 and name HN )( resid 101 and name HA ) 2.4 2.2 0.7
assign ( resid 101 and name HN )( resid 101 and name HB# ) 2.6 2.2 1.0
assign ( resid 101 and name HN )( resid 102 and name HG2# ) 3.2 2.2 2.2
assign ( resid 101 and name HN )( resid 103 and name HD2# ) 3.6 2.2 2.4
assign ( resid 101 and name HN )( resid 104 and name HB# ) 3.4 2.2 2.2
assign ( resid 101 and name HN )( resid 104 and name HG# ) 3.4 2.2 2.2
!assign ( resid 101 and name HN )( resid 20 and name HG1# ) 3.6 2.2 2.4
!assign ( resid 101 and name HN )( resid 97 and name HD1 ) 3.6 2.2 2.4
assign ( resid 101 and name HN )( resid 97 and name HD2 ) 3.6 2.2 2.4
assign ( resid 101 and name HN )( resid 98 and name HA ) 3.6 2.2 2.4
assign ( resid 102 and name HA )( resid 102 and name HB ) 2.9 2.2 1.2
assign ( resid 102 and name HA )( resid 20 and name HG2 ) 3.4 2.2 2.2
assign ( resid 102 and name HA )( resid 20 and name HG1 ) 3.6 2.2 2.4
assign ( resid 102 and name HB )( resid 36 and name HE2 ) 3.2 2.2 2.2
assign ( resid 102 and name HG2# )( resid 102 and name HB ) 3.6 2.2 2.4
assign ( resid 102 and name HG2# )( resid 103 and name HD2# ) 3.4 2.2 2.2
!assign ( resid 102 and name HG2# )( resid 36 and name HN ) 3.6 2.2 2.4
assign ( resid 102 and name HN )( resid 100 and name HB3 ) 3.6 2.2 2.4
assign ( resid 102 and name HN )( resid 101 and name HN ) 2.9 2.2 1.2
assign ( resid 102 and name HN )( resid 101 and name HA ) 2.9 2.2 1.2
assign ( resid 102 and name HN )( resid 101 and name HB# ) 3.2 2.2 1.5
assign ( resid 102 and name HN )( resid 102 and name HA ) 2.9 2.2 1.2
assign ( resid 102 and name HN )( resid 102 and name HB ) 2.9 2.2 1.2
assign ( resid 102 and name HN )( resid 102 and name HG2# ) 3.2 2.2 1.5
assign ( resid 102 and name HN )( resid 103 and name HD2# ) 3.4 2.2 2.2
assign ( resid 102 and name HN )( resid 103 and name HD2# ) 3.4 2.2 2.2
!assign ( resid 102 and name HN )( resid 10 and name HB1 ) 3.6 2.2 2.4
assign ( resid 102 and name HN )( resid 98 and name HD2# ) 3.6 2.2 2.4
assign ( resid 102 and name HN )( resid 98 and name HG ) 3.6 2.2 2.4
assign ( resid 103 and name HA )( resid 103 and name HD22 ) 3.6 2.2 2.4
assign ( resid 103 and name HA )( resid 104 and name HB# ) 3.6 2.2 2.4
!assign ( resid 103 and name HA )( resid 33 and name HD2 ) 3.6 2.2 2.4
assign ( resid 103 and name HB1 )( resid 103 and name HA ) 2.4 2.2 0.7
assign ( resid 103 and name HB1 )( resid 103 and name HB2 ) 2.9 2.2 1.2
assign ( resid 103 and name HB1 )( resid 103 and name HD21 ) 2.9 2.2 1.2
assign ( resid 103 and name HB1 )( resid 103 and name HB22 ) 2.9 2.2 1.2
assign ( resid 103 and name HB2 )( resid 102 and name HA ) 3.6 2.2 2.4
assign ( resid 103 and name HB2 )( resid 103 and name HN ) 2.9 2.2 1.2
assign ( resid 103 and name HB2 )( resid 103 and name HA ) 2.4 2.2 0.7
assign ( resid 103 and name HB2 )( resid 103 and name HD21 ) 2.9 2.2 1.2
assign ( resid 103 and name HB2 )( resid 103 and name HE22 ) 2.9 2.2 1.2
assign ( resid 103 and name HB2 )( resid 104 and name HN ) 2.9 2.2 1.2
assign ( resid 103 and name HN )( resid 101 and name HA ) 2.9 2.2 1.2
assign ( resid 103 and name HN )( resid 102 and name HN ) 2.9 2.2 1.2
assign ( resid 103 and name HN )( resid 102 and name HA ) 2.9 2.2 1.2
assign ( resid 103 and name HN )( resid 102 and name HB ) 3.6 2.2 2.4
assign ( resid 103 and name HN )( resid 102 and name HG2# ) 3.6 2.2 2.4
assign ( resid 103 and name HN )( resid 103 and name HA ) 2.6 2.2 1.0
assign ( resid 103 and name HN )( resid 103 and name HB1 ) 2.9 2.2 1.2
assign ( resid 103 and name HN )( resid 103 and name HD21 ) 3.4 2.2 2.2
assign ( resid 103 and name HN )( resid 103 and name HD22 ) 3.4 2.2 2.2
assign ( resid 103 and name HN )( resid 104 and name HA ) 3.6 2.2 2.4
assign ( resid 104 and name HA )( resid 104 and name HG# ) 3.4 2.2 2.2
!assign ( resid 104 and name HA )( resid 22 and name HN ) 3.4 2.2 2.2
assign ( resid 104 and name HB# )( resid 104 and name HA ) 3.4 2.2 2.2
assign ( resid 104 and name HB# )( resid 104 and name HG# ) 3.4 2.2 2.2
assign ( resid 104 and name HB# )( resid 104 and name HA ) 2.9 2.2 1.2
assign ( resid 104 and name HN )( resid 101 and name HA ) 3.4 2.2 2.2
!assign ( resid 104 and name HN )( resid 102 and name HA ) 2.9 2.2 1.2
assign ( resid 104 and name HN )( resid 103 and name HN ) 2.9 2.2 1.2
assign ( resid 104 and name HN )( resid 103 and name HA ) 2.6 2.2 1.0
assign ( resid 104 and name HN )( resid 103 and name HB1 ) 3.2 2.2 1.5
assign ( resid 104 and name HN )( resid 103 and name HD21 ) 3.4 2.2 2.2
assign ( resid 104 and name HN )( resid 104 and name HA ) 2.4 2.2 0.7
assign ( resid 104 and name HN )( resid 104 and name HB# ) 2.9 2.2 1.2
!Heme NOEs to both backbone and side chain peaks
!assign (resid 201 and name HBB#) (resid  9 and name HG2#) 3.6 2.2 2.4
assign (resid 201 and name HAB) (resid  15 and name HN) 3.5 1.7 2.2
assign (resid 201 and name HD) (resid  28 and name HG2#) 3.4 2.2 2.2
!assign (resid 201 and name HMD) (resid  28 and name HG2#) 3.6 2.2 2.4
assign (resid 201 and name HAC) (resid  28 and name HG2#) 3.9 2.0 3.0
assign (resid 201 and name HMD#) (resid  29 and name HA#) 3.9 2.0 2.4
assign (resid 201 and name HB) (resid  32 and name HD2#) 3.4 2.2 2.2
assign (resid 201 and name HAA2#) (resid  32 and name HD2#) 3.6 2.2 2.4
assign (resid 201 and name HB) (resid  35 and name HD1#) 3.6 2.2 2.4
assign (resid 201 and name HMA#) (resid  35 and name HD2#) 2.9 2.2 1.2
assign (resid 201 and name HMA#) (resid  35 and name HD1#) 2.9 2.2 1.2
assign (resid 201 and name HAA#) (resid  35 and name HD1#) 3.6 2.2 2.4
assign (resid 201 and name HBA#) (resid  41 and name HN) 3.6 2.2 2.4
assign (resid 201 and name HBA#) (resid  41 and name HA2) 3.4 2.2 2.2
assign (resid 201 and name HBA#) (resid  43 and name HB) 3.6 2.2 2.4
!assign (resid 201 and name HMD#) (resid  46 and name HZ) 3.9 2.0 2.6
assign (resid 201 and name HAD#) (resid  47 and name HG2#) 4.05 2.0 3.4
assign (resid 201 and name HMD#) (resid  49 and name HG2#) 3.6 2.2 2.4
assign (resid 201 and name HBD1) (resid  49 and name HG2#) 3.6 2.2 2.4
assign (resid 201 and name HBA1) (resid  59 and name HE1#) 3.4 2.2 2.2
assign (resid 201 and name HBA2) (resid  59 and name HE1#) 3.4 2.2 2.2
assign (resid 201 and name HAA2) (resid  59 and name HE1#) 3.4 2.2 2.2
assign (resid 201 and name HMA#) (resid  64 and name HD2#) 3.4 2.2 2.2
assign (resid 201 and name HMB#) (resid  64 and name HD2#) 3.6 2.2 2.4
assign (resid 201 and name HMA#) (resid  64 and name HD1#) 3.6 2.2 2.4
!assign (resid 201 and name HAD#) (resid  78 and name HB) 3.6 2.2 2.4
assign (resid 201 and name HBD#) (resid  78 and name HG1) 3.4 2.2 2.2

!H-bonds
assign (resid   201 and  name CAB    )(resid   14 and  name SG   ) 1.8 0.1 0.5
assign (resid   201 and  name CAC    )(resid   17 and  name SG   ) 1.8 0.1 0.5
assign (resid   201 and  name FE    )(resid   18 and  name NE2   ) 2.06 0.1 0.5
assign (resid   201 and  name FE    )(resid   80 and  name SD   ) 2.5 0.1 1.0
assign (resid   2 and  name O    )(resid   6 and  name HN   ) 2.0 0.1 0.5
assign (resid   2 and  name O    )(resid   6 and  name N    ) 3.0 0.1 0.5
assign (resid   3 and  name O    )(resid   7 and  name HN   ) 2.0 0.1 0.5
assign (resid   3 and  name O    )(resid   7 and  name N    ) 3.0 0.1 0.5
assign (resid   4 and  name O    )(resid   8 and  name HN   ) 2.0 0.1 0.5
assign (resid   4 and  name O    )(resid   8 and  name N    ) 3.0 0.1 0.5
assign (resid   5 and  name O    )(resid   9 and  name HN   ) 2.0 0.1 0.5
assign (resid   5 and  name O    )(resid   9 and  name N    ) 3.0 0.1 0.5
assign (resid   6 and  name O    )(resid   10 and  name HN   ) 2.0 0.1 0.5
assign (resid   6 and  name O    )(resid   10 and  name N    ) 3.0 0.1 0.5
assign (resid   7 and  name O    )(resid   11 and  name HN   ) 2.0 0.1 0.5
assign (resid   7 and  name O    )(resid   11 and  name N    ) 3.0 0.1 0.5
assign (resid   8 and  name O    )(resid   12 and  name HN   ) 2.0 0.1 0.5
assign (resid   8 and  name O    )(resid   12 and  name N    ) 3.0 0.1 0.5
assign (resid   9 and  name O    )(resid   13 and  name HN   ) 2.0 0.1 0.5
assign (resid   9 and  name O    )(resid   13 and  name N    ) 3.0 0.1 0.5
assign (resid   10 and  name O    )(resid   14 and  name HN   ) 2.0 0.1 0.5
assign (resid   10 and  name O    )(resid   14 and  name N    ) 3.0 0.1 0.5
assign (resid   10 and  name O    )(resid   15 and  name HN   ) 2.0 0.1 0.5
assign (resid   14 and  name O    )(resid   17 and  name HN   ) 2.0 0.2 0.6
assign (resid   18 and  name HN    )(resid   15 and  name O   ) 2.0 0.2 0.6
assign (resid   24 and  name HN    )(resid   21 and  name O   ) 2.0 0.2 0.6
!assign (resid   68 and  name O    )(resid   85 and  name HN   ) 1.9 0.2 0.6
assign (resid   35 and  name HN    )(resid   32 and  name O   ) 2.0 0.2 0.6
!assign (resid   37 and  name HN    )(resid   59 and  name O   ) 2.0 0.2 0.6
!assign (resid   59 and  name HN    )(resid   38 and  name O   ) 2.0 0.2 0.6
assign (resid   49 and  name O    )(resid   53 and  name HN   ) 2.0 0.2 0.6
assign (resid   49 and  name O    )(resid   53 and  name N    ) 3.0 0.1 0.5
assign (resid   50 and  name O    )(resid   54 and  name HN   ) 2.0 0.1 0.5
assign (resid   50 and  name O    )(resid   54 and  name N    ) 3.0 0.1 0.5
assign (resid   51 and  name O    )(resid   55 and  name HN   ) 2.0 0.1 0.5
assign (resid   51 and  name O    )(resid   55 and  name N    ) 3.0 0.1 0.5
assign (resid   60 and  name O    )(resid   64 and  name HN   ) 2.0 0.1 0.5
assign (resid   60 and  name O    )(resid   64 and  name N    ) 3.0 0.1 0.5
assign (resid   61 and  name O    )(resid   65 and  name HN   ) 2.0 0.1 0.5
assign (resid   61 and  name O    )(resid   65 and  name N    ) 3.0 0.1 0.5
assign (resid   62 and  name O    )(resid   66 and  name HN   ) 2.0 0.1 0.5
assign (resid   62 and  name O    )(resid   66 and  name N    ) 3.0 0.1 0.5
assign (resid   63 and  name O    )(resid   67 and  name HN   ) 2.0 0.1 0.5
assign (resid   63 and  name O    )(resid   67 and  name N    ) 3.0 0.1 0.5
assign (resid   64 and  name O    )(resid   68 and  name HN   ) 2.0 0.1 0.5
assign (resid   64 and  name O    )(resid   68 and  name N    ) 3.0 0.1 0.5
assign (resid   70 and  name O    )(resid   74 and  name HN   ) 2.0 0.1 0.5
assign (resid   70 and  name O    )(resid   74 and  name N    ) 3.0 0.1 0.5
assign (resid   71 and  name O    )(resid   75 and  name HN   ) 2.0 0.1 0.5
assign (resid   71 and  name O    )(resid   75 and  name N    ) 3.0 0.1 0.5
assign (resid   87 and  name O    )(resid   91 and  name HN   ) 2.0 0.1 0.5
assign (resid   87 and  name O    )(resid   91 and  name N    ) 3.0 0.1 0.5
assign (resid   88 and  name O    )(resid   92 and  name HN   ) 2.0 0.1 0.5
assign (resid   88 and  name O    )(resid   92 and  name N    ) 3.0 0.1 0.5
assign (resid   89 and  name O    )(resid   93 and  name HN   ) 2.0 0.1 0.5
assign (resid   89 and  name O    )(resid   93 and  name N    ) 3.0 0.1 0.5
assign (resid   91 and  name O    )(resid   95 and  name HN   ) 2.0 0.1 0.5
assign (resid   91 and  name O    )(resid   95 and  name N    ) 3.0 0.1 0.5
assign (resid   92 and  name O    )(resid   96 and  name HN   ) 2.0 0.1 0.5
assign (resid   92 and  name O    )(resid   96 and  name N    ) 3.0 0.1 0.5
assign (resid   93 and  name O    )(resid   97 and  name HN   ) 2.0 0.1 0.5
assign (resid   93 and  name O    )(resid   97 and  name N    ) 3.0 0.1 0.5
assign (resid   95 and  name O    )(resid   99 and  name HN   ) 2.0 0.1 0.5
assign (resid   95 and  name O    )(resid   99 and  name N    ) 3.0 0.1 0.5
assign (resid   96 and  name O    )(resid   100 and  name HN   ) 2.0 0.1 0.5
assign (resid   96 and  name O    )(resid   100 and  name N    ) 3.0 0.1 0.5
assign (resid   97 and  name O    )(resid   101 and  name HN   ) 2.0 0.1 0.5
assign (resid   97 and  name O    )(resid   101 and  name N    ) 3.0 0.1 0.5
assign (resid   98 and  name O    )(resid   102 and  name N    ) 3.0 0.1 0.5
assign (resid   98 and  name O    )(resid   102 and  name HN   ) 2.0 0.1 0.5
assign (resid   99 and  name O    )(resid   103 and  name N    ) 3.0 0.1 0.5
assign (resid   99 and  name O    )(resid   103 and  name HN   ) 2.0 0.1 0.5
assign (resid   100 and  name O    )(resid   104 and  name N    ) 3.0 0.1 0.5
assign (resid   100 and  name O    )(resid   104 and  name HN   ) 2.0 0.1 0.5
!NON secondary structure (longer range) H-bond restraints
assign (resid   41 and  name HN    )(resid   201 and  name O2A   ) 2.0 0.2 0.6
assign (resid   30 and  name O    )(resid   18 and  name HD1   ) 2.0 0.2 0.6
assign (resid   19 and  name HG1    )(resid   25 and  name O   ) 2.0 0.2 0.6

!remark phi, psi angle constraints
! determined via TALOS

 !! D2 PHI
 assign (resid 2 and name c) (resid 2 and name ca)
        (resid 2 and name n) (resid 1 and name c)   1.0 -102 28 2
 
 !! D2 PSI
 assign (resid 2 and name n) (resid 2 and name ca)
        (resid 2 and name c) (resid 3 and name n)   1.0  139 26 2
 
 !! V3 PHI
 assign (resid 3 and name c) (resid 3 and name ca)
        (resid 3 and name n) (resid 2 and name c)   1.0 -57 6 2
 
 !! V3 PSI
 assign (resid 3 and name n) (resid 3 and name ca)
        (resid 3 and name c) (resid 4 and name n)   1.0 -40 11 2
 
 !! E4 PHI
 assign (resid 4 and name c) (resid 4 and name ca)
        (resid 4 and name n) (resid 3 and name c)   1.0 -63 4 2
 
 !! E4 PSI
 assign (resid 4 and name n) (resid 4 and name ca)
        (resid 4 and name c) (resid 5 and name n)   1.0 -42 4 2
 
 !! K5 PHI
 assign (resid 5 and name c) (resid 5 and name ca)
        (resid 5 and name n) (resid 4 and name c)   1.0 -65 5 2
 
 !! K5 PSI
 assign (resid 5 and name n) (resid 5 and name ca)
        (resid 5 and name c) (resid 6 and name n)   1.0 -38 4 2
 
 !! G6 PHI
 assign (resid 6 and name c) (resid 6 and name ca)
        (resid 6 and name n) (resid 5 and name c)   1.0 -65 4 2
 
 !! G6 PSI
 assign (resid 6 and name n) (resid 6 and name ca)
        (resid 6 and name c) (resid 7 and name n)   1.0 -38 4 2
 
 !! K7 PHI
 assign (resid 7 and name c) (resid 7 and name ca)
        (resid 7 and name n) (resid 6 and name c)   1.0 -61 4 2
 
 !! K7 PSI
 assign (resid 7 and name n) (resid 7 and name ca)
        (resid 7 and name c) (resid 8 and name n)   1.0 -44 5 2

 !! K8 PHI
 assign (resid 8 and name c) (resid 8 and name ca)
        (resid 8 and name n) (resid 7 and name c)   1.0 -62 4 2
 
 !! K8 PSI
 assign (resid 8 and name n) (resid 8 and name ca)
        (resid 8 and name c) (resid 9 and name n)   1.0 -36 7 2

 !! I9 PHI
 assign (resid 9 and name c) (resid 9 and name ca)
        (resid 9 and name n) (resid 8 and name c)   1.0 -68 6 2
 
 !! I9 PSI
 assign (resid 9 and name n) (resid 9 and name ca)
        (resid 9 and name c) (resid 10 and name n)  1.0 -40 6 2

 !! F10 PHI
 assign (resid 10 and name c) (resid 10 and name ca)
        (resid 10 and name n) (resid 9 and name c)   1.0 -62 3 2
 
 !! F10 PSI
 assign (resid 10 and name n) (resid 10 and name ca)
        (resid 10 and name c) (resid 11 and name n)   1.0 -43 5 2

 !! V11 PHI
 assign (resid 11 and name c) (resid 11 and name ca)
        (resid 11 and name n) (resid 10 and name c)   1.0 -61 9 2
 
 !! V11 PSI
 assign (resid 11 and name n) (resid 11 and name ca)
        (resid 11 and name c) (resid 12 and name n)   1.0 -44 5 2

 !! Q12 PHI
 assign (resid 12 and name c) (resid 12 and name ca)
        (resid 12 and name n) (resid 11 and name c)   1.0 -74 10 2
 
 !! Q12 PSI
 assign (resid 12 and name n) (resid 12 and name ca)
        (resid 12 and name c) (resid 13 and name n)   1.0 -28 11 2

 !! K13 PHI
 assign (resid 13 and name n) (resid 13 and name ca)
        (resid 13 and name c) (resid 12 and name n)   1.0 -80 17 2

 !! K13 PSI
 assign (resid 13 and name n) (resid 13 and name ca)
        (resid 13 and name c) (resid 14 and name n)   1.0 -32 22 2

 !! A15 PHI
 assign (resid 15 and name c) (resid 15 and name ca)
        (resid 15 and name n) (resid 14 and name c)   1.0 -64 10 2
 
 !! A15 PSI
 assign (resid 15 and name n) (resid 15 and name ca)
        (resid 15 and name c) (resid 16 and name n)   1.0 -40 10 2

 !! Q16 PHI
 assign (resid 16 and name c) (resid 16 and name ca)
        (resid 16 and name n) (resid 15 and name c)   1.0 -64 10 2
 
 !! Q16 PSI
 assign (resid 16 and name n) (resid 16 and name ca)
        (resid 16 and name c) (resid 17 and name n)   1.0 -46 10 2

 !! C17 PHI
 assign (resid 17 and name c) (resid 17 and name ca)
        (resid 17 and name n) (resid 16 and name c)   1.0 -65 14 2
 
 !! C17 PSI
 assign (resid 17 and name n) (resid 17 and name ca)
        (resid 17 and name c) (resid 18 and name n)   1.0 -22 24 2

 !! H18 PHI
 assign (resid 18 and name c) (resid 18 and name ca)
        (resid 18 and name n) (resid 17 and name c)   1.0 -88 29 2
 
 !! H18 PSI
 assign (resid 18 and name n) (resid 18 and name ca)
        (resid 18 and name c) (resid 19 and name n)   1.0 -10 30 2

 !! V20 PHI
 assign (resid 20 and name c) (resid 20 and name ca)
        (resid 20 and name n) (resid 19 and name c)   1.0 -105 27 2
 
 !! V20 PSI
 assign (resid 20 and name n) (resid 20 and name ca)
        (resid 20 and name c) (resid 21 and name n)   1.0 -153 13 2

 !! E21 PHI
 assign (resid 21 and name c) (resid 21 and name ca)
        (resid 21 and name n) (resid 20 and name c)   1.0 -95 28 2
 
 !! E21 PSI
 assign (resid 21 and name n) (resid 21 and name ca)
        (resid 21 and name c) (resid 22 and name n)   1.0 118 27 2

 !! K22 PHI
 assign (resid 22 and name c) (resid 22 and name ca)
        (resid 22 and name n) (resid 21 and name c)   1.0 -67 14 2
 
 !! K22 PSI
 assign (resid 22 and name n) (resid 22 and name ca)
        (resid 22 and name c) (resid 23 and name n)   1.0 129 8 2

 !! K25 PHI
 assign (resid 25 and name c) (resid 25 and name ca)
        (resid 25 and name n) (resid 24 and name c)   1.0  -87 23 2
 
 !! K25 PSI
 assign (resid 25 and name n) (resid 25 and name ca)
        (resid 25 and name c) (resid 26 and name n)   1.0  137 29 2

 !! H26 PHI
 assign (resid 26 and name c) (resid 26 and name ca)
        (resid 26 and name n) (resid 25 and name c)   1.0 -81 18 2
 
 !! H26 PSI
 assign (resid 26 and name n) (resid 26 and name ca)
        (resid 26 and name c) (resid 27 and name n)   1.0 135 6 2

 !! K27 PHI
 assign (resid 27 and name c) (resid 27 and name ca)
        (resid 27 and name n) (resid 26 and name c)   1.0 -94  7 2
 
 !! K27 PSI
 assign (resid 27 and name n) (resid 27 and name ca)
        (resid 27 and name c) (resid 28 and name n)   1.0 134  39 2

 !! T28 PHI
 assign (resid 28 and name c) (resid 28 and name ca)
        (resid 28 and name n) (resid 27 and name c)   1.0 -70 12 2
 
 !! T28 PSI
 assign (resid 28 and name n) (resid 28 and name ca)
        (resid 28 and name c) (resid 29 and name n)  1.0 -37 11 2

 !! N31 PHI
 assign (resid 31 and name c) (resid 31 and name ca)
        (resid 31 and name n) (resid 30 and name c)  1.0 -84 30 2
 
 !! N31 PSI
 assign (resid 31 and name n) (resid 31 and name ca)
        (resid 31 and name c) (resid 32 and name n)  1.0 -23 38 2

 !! H33 PHI
 assign (resid 33 and name c) (resid 33 and name ca)
        (resid 33 and name n) (resid 32 and name c)  1.0 -55 6 2
 
 !! H33 PSI
 assign (resid 33 and name n) (resid 33 and name ca)
        (resid 33 and name c) (resid 34 and name n)  1.0 130 6 2

 !! L35 PHI
 assign (resid 35 and name c) (resid 35 and name ca)
        (resid 35 and name n) (resid 34 and name c)   1.0 -60 16 2
 
 !! L35 PSI
 assign (resid 35 and name n) (resid 35 and name ca)
        (resid 35 and name c) (resid 36 and name n)   1.0 -36 12 2

 !! R38 PHI
 assign (resid 38 and name c) (resid 38 and name ca)
        (resid 38 and name n) (resid 37 and name c)   1.0 -118 29 2
 
 !! R38 PSI
 assign (resid 38 and name n) (resid 38 and name ca)
        (resid 38 and name c) (resid 39 and name n)   1.0 146 22 2

 !! G41 PHI
 assign (resid 41 and name c) (resid 41 and name ca)
        (resid 41 and name n) (resid 40 and name c)   1.0 63 8 2
 
 !! G41 PSI
 assign (resid 41 and name n) (resid 41 and name ca)
        (resid 41 and name c) (resid 42 and name n)   1.0 30 7 2

 !! Q42 PHI
 assign (resid 42 and name c) (resid 42 and name ca)
        (resid 42 and name n) (resid 41 and name c)   1.0 -109 36 2
 
 !! Q42 PSI
 assign (resid 42 and name n) (resid 42 and name ca)
        (resid 42 and name c) (resid 43 and name n)   1.0 14 30 2

 !! F46 PHI
 assign (resid 46 and name c) (resid 46 and name ca)
        (resid 46 and name n) (resid 45 and name c)   1.0 -103 21 2
 
 !! F46 PSI
  assign (resid 46 and name n) (resid 46 and name ca)
         (resid 46 and name c) (resid 47 and name n)  1.0 124 10 2

 !! T47 PHI
  assign (resid 47 and name c) (resid 47 and name ca)
         (resid 47 and name n) (resid 46 and name c)  1.0 -106 25 2
 
 !! T47 PSI
 assign (resid 47 and name n) (resid 47 and name ca)
        (resid 47 and name c) (resid 48 and name n)   1.0 109 24 2

 !! Y48 PHI
  assign (resid 48 and name c) (resid 48 and name ca)
         (resid 48 and name n) (resid 47 and name c)  1.0 -92 27 2
 
 !! Y48 PSI
 assign (resid 48 and name n) (resid 48 and name ca)
        (resid 48 and name c) (resid 49 and name n)   1.0 148 11 2

 !! T49 PHI
 assign (resid 49 and name c) (resid 49 and name ca)
        (resid 49 and name n) (resid 48 and name c)   1.0 -82 7 2
 
 !! T49 PSI
  assign (resid 49 and name n) (resid 49 and name ca)
         (resid 49 and name c) (resid 50 and name n)  1.0 165 5 2

 !! D50 PHI
  assign (resid 50 and name c) (resid 50 and name ca)
         (resid 50 and name n) (resid 49 and name c)  1.0 -60 5 2
 
 !! D50 PSI
 assign (resid 50 and name n) (resid 50 and name ca)
        (resid 50 and name c) (resid 51 and name n)   1.0 -40 4 2

 !! A51 PHI
 assign (resid 51 and name c) (resid 51 and name ca)
        (resid 51 and name n) (resid 50 and name c)   1.0 -65 5 2
 
 !! A51 PSI
 assign (resid 51 and name n) (resid 51 and name ca)
        (resid 51 and name c) (resid 52 and name n)   1.0 -42 3 2

 !! N52 PHI
 assign (resid 52 and name c) (resid 52 and name ca)
        (resid 52 and name n) (resid 51 and name c)   1.0 -65 4 2
 
 !! N52 PSI
 assign (resid 52 and name n) (resid 52 and name ca)
        (resid 52 and name c) (resid 53 and name n)   1.0 -38 6 2

 !! N54 PHI
 assign (resid 54 and name c) (resid 54 and name ca)
        (resid 54 and name n) (resid 53 and name c)   1.0 -91 15 2
 
 !! N54 PSI
 assign (resid 54 and name n) (resid 54 and name ca)
        (resid 54 and name c) (resid 55 and name n)   1.0  -12 13 2

 !! k55 PHI
 assign (resid 55 and name c) (resid 55 and name ca)
        (resid 55 and name n) (resid 54 and name c)   1.0 58 15 2
 
 !! k55 PSI
 assign (resid 55 and name n) (resid 55 and name ca)
        (resid 55 and name c) (resid 56 and name n)   1.0 36 27 2

 !! I57 PHI
 assign (resid 57 and name c) (resid 57 and name ca)
        (resid 57 and name n) (resid 56 and name c)   1.0 -134 13 2
 
 !! I57 PSI
 assign (resid 57 and name n) (resid 57 and name ca)
        (resid 57 and name c) (resid 58 and name n)   1.0  161 8 2

 !! T58 PHI
 assign (resid 58 and name c) (resid 58 and name ca)
        (resid 58 and name n) (resid 57 and name c)   1.0 -104 23 2
 
 !! T58 PSI
 assign (resid 58 and name n) (resid 58 and name ca)
        (resid 58 and name c) (resid 59 and name n)   1.0 124 9 2

 !! W59 PHI
 assign (resid 59 and name c) (resid 59 and name ca)
        (resid 59 and name n) (resid 58 and name c)   1.0 -93 28 2
 
 !! W59 PSI
 assign (resid 59 and name n) (resid 59 and name ca)
        (resid 59 and name c) (resid 60 and name n)   1.0 134 25 2

 !! K60 PHI
 assign (resid 60 and name c) (resid 60 and name ca)
        (resid 60 and name n) (resid 59 and name c)   1.0 -117 38 2
 
 !! K60 PSI
 assign (resid 60 and name n) (resid 60 and name ca)
        (resid 60 and name c) (resid 61 and name n)   1.0 143 28 2

 !! E61 PHI
 assign (resid 61 and name c) (resid 61 and name ca)
        (resid 61 and name n) (resid 60 and name c)   1.0 -55 7 2
 
 !! E61 PSI
 assign (resid 61 and name n) (resid 61 and name ca)
        (resid 61 and name c) (resid 62 and name n)   1.0 -48 9 2

 !! E62 PHI
 assign (resid 62 and name c) (resid 62 and name ca)
        (resid 62 and name n) (resid 61 and name c)   1.0 -59 4 2
 
 !! E62 PSI
 assign (resid 62 and name n) (resid 62 and name ca)
        (resid 62 and name c) (resid 63 and name n)   1.0 -41 6 2

 !! T63 PHI
 assign (resid 63 and name c) (resid 63 and name ca)
        (resid 63 and name n) (resid 62 and name c)   1.0 -71 7 2
 
 !! T63 PSI
 assign (resid 63 and name n) (resid 63 and name ca)
        (resid 63 and name c) (resid 64 and name n)   1.0 -38 10 2

 !! L64 PHI
 assign (resid 64 and name c) (resid 64 and name ca)
        (resid 64 and name n) (resid 63 and name c)   1.0 -65 7 2
 
 !! L64 PSI
 assign (resid 64 and name n) (resid 64 and name ca)
        (resid 64 and name c) (resid 65 and name n)   1.0 -41 6 2

 !! M65 PHI
 assign (resid 65 and name c) (resid 65 and name ca)
        (resid 65 and name n) (resid 64 and name c)  1.0 -64 4 2
 
 !! M65 PSI
  assign (resid 65 and name n) (resid 65 and name ca)
         (resid 65 and name c) (resid 66 and name n)  1.0 -39 4 2

 !! E66 PHI
 assign (resid 66 and name c) (resid 66 and name ca)
        (resid 66 and name n) (resid 65 and name c)   1.0 -69 9 2
 
 !! E66 PSI
 assign (resid 66 and name n) (resid 66 and name ca)
        (resid 66 and name c) (resid 67 and name n)   1.0 -40 3 2

 !! Y67 PHI
 assign (resid 67 and name c) (resid 67 and name ca)
        (resid 67 and name n) (resid 66 and name c)   1.0 -65 12 2
 
 !! Y67 PSI
 assign (resid 67 and name n) (resid 67 and name ca)
        (resid 67 and name c) (resid 68 and name n)   1.0 -35 19 2

 !! L68 PHI
 assign (resid 68 and name c) (resid 68 and name ca)
        (resid 68 and name n) (resid 67 and name c)   1.0 -73 11 2
 
 !! L68 PSI
 assign (resid 68 and name n) (resid 68 and name ca)
        (resid 68 and name c) (resid 69 and name n)   1.0 -22 18 2

 !! P71 PHI
 assign (resid 71 and name c) (resid 71 and name ca)
        (resid 71 and name n) (resid 70 and name c)   1.0 -54 10 2
 
 !! P71 PSI
 assign (resid 71 and name n) (resid 71 and name ca)
        (resid 71 and name c) (resid 72 and name n)   1.0 -38 11 2

 !! K72 PHI
 assign (resid 72 and name c) (resid 72 and name ca)
        (resid 72 and name n) (resid 71 and name c)   1.0 -65 15 2
 
 !! K72 PSI
 assign (resid 72 and name n) (resid 72 and name ca)
        (resid 72 and name c) (resid 73 and name n)   1.0 -30 19 2

 !! K73 PHI
 assign (resid 73 and name c) (resid 73 and name ca)
        (resid 73 and name n) (resid 72 and name c)   1.0 -67 14 2
 
 !! K73 PSI
 assign (resid 73 and name n) (resid 73 and name ca)
        (resid 73 and name c) (resid 74 and name n)   1.0 -37 12 2

 !! Y74 PHI
 assign (resid 74 and name c) (resid 74 and name ca)
        (resid 74 and name n) (resid 73 and name c)   1.0 -76 12 2
 
 !! Y74 PSI
 assign (resid 74 and name n) (resid 74 and name ca)
        (resid 74 and name c) (resid 75 and name n)   1.0 -32 12 2

 !! I75 PHI
 assign (resid 75 and name c) (resid 75 and name ca)
        (resid 75 and name n) (resid 74 and name c)   1.0 -129 40 2
 
 !! I75 PSI
 assign (resid 75 and name n) (resid 75 and name ca)
        (resid 75 and name c) (resid 76 and name n)   1.0 125 46 2

 !! P76 PHI
 assign (resid 76 and name c) (resid 76 and name ca)
        (resid 76 and name n) (resid 75 and name c)   1.0 -63 14 2
 
 !! P76 PSI
 assign (resid 76 and name n) (resid 76 and name ca)
        (resid 76 and name c) (resid 77 and name n)   1.0 141 9 2

 !! G77 PHI
 assign (resid 77 and name c) (resid 77 and name ca)
        (resid 77 and name n) (resid 76 and name c)   1.0  92 14 2
 
 !! G77 PSI
 assign (resid 77 and name n) (resid 77 and name ca)
        (resid 77 and name c) (resid 78 and name n)   1.0 -14 13 2

 !! T78 PHI
 assign (resid 78 and name c) (resid 78 and name ca)
        (resid 78 and name n) (resid 77 and name c)   1.0 -107 29 2
 
 !! T78 PSI
 assign (resid 78 and name n) (resid 78 and name ca)
        (resid 78 and name c) (resid 79 and name n)   1.0  141 13 2

 !! K79 PHI
 assign (resid 79 and name c) (resid 79 and name ca)
        (resid 79 and name n) (resid 78 and name c)   1.0 -93 14 2
 
 !! K79 PSI
 assign (resid 79 and name n) (resid 79 and name ca)
        (resid 79 and name c) (resid 80 and name n)   1.0  153 13 2

 !! M80 PHI
 assign (resid 80 and name c) (resid 80 and name ca)
        (resid 80 and name n) (resid 79 and name c)   1.0 -79 26 2
 
 !! M80 PSI
 assign (resid 80 and name n) (resid 80 and name ca)
        (resid 80 and name c) (resid 81 and name n)   1.0 121 9 2

 !! I81 PHI
 assign (resid 81 and name c) (resid 81 and name ca)
        (resid 81 and name n) (resid 80 and name c)   1.0 -96 11 2
 
 !! I81 PSI
 assign (resid 81 and name n) (resid 81 and name ca)
        (resid 81 and name c) (resid 82 and name n)   1.0 118 12 2

 !! I85 PHI
 assign (resid 85 and name c) (resid 85 and name ca)
        (resid 85 and name n) (resid 84 and name c)   1.0 -108  24 2
 
 !! I85 PSI
 assign (resid 85 and name n) (resid 85 and name ca)
        (resid 85 and name c) (resid 86 and name n)   1.0 136 11 2

 !! K88 PHI
 assign (resid 88 and name c) (resid 88 and name ca)
        (resid 88 and name n) (resid 87 and name c)   1.0 -55 5 2
 
 !! K88 PSI
 assign (resid 88 and name n) (resid 88 and name ca)
        (resid 88 and name c) (resid 89 and name n)   1.0 -42 8 2

 !! T89 PHI
 assign (resid 89 and name c) (resid 89 and name ca)
        (resid 89 and name n) (resid 88 and name c)   1.0 -63 6 2
 
 !! T89 PSI
 assign (resid 89 and name n) (resid 89 and name ca)
        (resid 89 and name c) (resid 90 and name n)   1.0 -34 13 2

 !! E90 PHI
 assign (resid 90 and name c) (resid 90 and name ca)
        (resid 90 and name n) (resid 89 and name c)   1.0 -68 6 2
 
 !! E90 PSI
 assign (resid 90 and name n) (resid 90 and name ca)
        (resid 90 and name c) (resid 91 and name n)   1.0 -38 9 2

 !! R91 PHI
 assign (resid 91 and name c) (resid 91 and name ca)
        (resid 91 and name n) (resid 90 and name c)   1.0 -59 9 2
 
 !! R91 PSI
 assign (resid 91 and name n) (resid 91 and name ca)
        (resid 91 and name c) (resid 92 and name n)   1.0 -50 9 2

 !! E92 PHI
 assign (resid 92 and name c) (resid 92 and name ca)
        (resid 92 and name n) (resid 91 and name c)   1.0 -61 4 2
 
 !! E92 PSI
 assign (resid 92 and name n) (resid 92 and name ca)
        (resid 92 and name c) (resid 93 and name n)   1.0 -43 5 2

 !! D93 PHI
 assign (resid 93 and name c) (resid 93 and name ca)
        (resid 93 and name n) (resid 92 and name c)   1.0 -63 4 2
 
 !! D93 PSI
 assign (resid 93 and name n) (resid 93 and name ca)
        (resid 93 and name c) (resid 94 and name n)   1.0 -41 6 2

 !! G94 PHI
 assign (resid 94 and name c) (resid 94 and name ca)
        (resid 94 and name n) (resid 93 and name c)   1.0 -61 6 2
 
 !! G94 PSI
 assign (resid 94 and name n) (resid 94 and name ca)
        (resid 94 and name c) (resid 95 and name n)   1.0 -39 5 2

 !! I95 PHI
 assign (resid 95 and name c) (resid 95 and name ca)
        (resid 95 and name n) (resid 94 and name c)   1.0 -65 6 2
 
 !! I95 PSI
 assign (resid 95 and name n) (resid 95 and name ca)
        (resid 95 and name c) (resid 96 and name n)   1.0 -43 5 2

 !! A96 PHI
 assign (resid 96 and name c) (resid 96 and name ca)
        (resid 96 and name n) (resid 95 and name c)   1.0 -62 5 2
 
 !! A96 PSI
 assign (resid 96 and name n) (resid 96 and name ca)
        (resid 96 and name c) (resid 97 and name n)   1.0 -43 5 2

 !! Y97 PHI
 assign (resid 97 and name c) (resid 97 and name ca)
        (resid 97 and name n) (resid 96 and name c)   1.0 -62 4 2
 
 !! Y97 PSI
 assign (resid 97 and name n) (resid 97 and name ca)
        (resid 97 and name c) (resid 98 and name n)   1.0 -46 8 2

 !! L98 PHI
 assign (resid 98 and name c) (resid 98 and name ca)
        (resid 98 and name n) (resid 97 and name c)   1.0 -62 4 2
 
 !! L98 PSI
 assign (resid 98 and name n) (resid 98 and name ca)
        (resid 98 and name c) (resid 99 and name n)   1.0 -39 5 2

 !! K99 PHI
 assign (resid 99 and name c) (resid 99 and name ca)
        (resid 99 and name n) (resid 98 and name c)   1.0 -66 7 2
 
 !! K99 PSI
 assign (resid 99 and name n) (resid 99 and name ca)
        (resid 99 and name c) (resid 100 and name n)  1.0 -38 6 2

 !! K100 PHI
 assign (resid 100 and name c) (resid 100 and name ca)
        (resid 100 and name n) (resid 99 and name c)   1.0 -66 11 2
 
 !! K100 PSI
 assign (resid 100 and name n) (resid 100 and name ca)
        (resid 100 and name c) (resid 101 and name n)  1.0 -23 13 2

 !! A101 PHI
 assign (resid 101 and name c) (resid 101 and name ca)
        (resid 101 and name n) (resid 100 and name c)   1.0 -64 10 2
 
 !! A101 PSI
 assign (resid 101 and name n) (resid 101 and name ca)
        (resid 101 and name c) (resid 102 and name n)  1.0 -36 8 2

 !! T102 PHI
 assign (resid 102 and name c) (resid 102 and name ca)
        (resid 102 and name n) (resid 101 and name c)   1.0 -113 9 2
 
 !! T102 PSI
 assign (resid 102 and name n) (resid 102 and name ca)
        (resid 102 and name c) (resid 103 and name n)  1.0 -1 20 2

 !! T103 PHI
 assign (resid 103 and name c) (resid 103 and name ca)
        (resid 103 and name n) (resid 102 and name c)   1.0 -129 25 2
 
 !! T103 PSI
 assign (resid 103 and name n) (resid 103 and name ca)
        (resid 103 and name c) (resid 104 and name n)  1.0  126 10 2
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1          1H        GLY   1 -19.365   3.927  -0.372
    2    H2   GLY   1          2H        GLY   1 -18.757   3.400  -1.859
    3    H3   GLY   1          3H        GLY   1 -18.927   5.055  -1.556
    4    HA2  GLY   1           HA2      GLY   1 -17.293   3.686   0.381
    5    HA3  GLY   1           HA3      GLY   1 -16.642   3.647  -1.250
    6    H    ASP   2           H        ASP   2 -16.579   5.319   1.561
    7    HA   ASP   2           HA       ASP   2 -16.000   7.873   0.211
    8    HB2  ASP   2           HB3      ASP   2 -16.605   7.578   3.148
    9    HB3  ASP   2           HB2      ASP   2 -16.649   9.040   2.165
   10    H    VAL   3           H        VAL   3 -14.230   9.142   1.082
   11    HA   VAL   3           HA       VAL   3 -11.873   7.643   1.401
   12    HB   VAL   3           HB       VAL   3 -12.565  10.528   1.534
   13   HG11  VAL   3          HG11      VAL   3 -11.235  10.601   3.434
   14   HG12  VAL   3          HG12      VAL   3 -10.081  10.919   2.139
   15   HG13  VAL   3          HG13      VAL   3 -10.174   9.313   2.863
   16   HG21  VAL   3          HG21      VAL   3 -11.812  10.250  -0.549
   17   HG22  VAL   3          HG22      VAL   3 -11.087   8.688  -0.165
   18   HG23  VAL   3          HG23      VAL   3 -10.199  10.176   0.162
   19    H    GLU   4           H        GLU   4 -13.908   9.358   3.736
   20    HA   GLU   4           HA       GLU   4 -12.267   9.089   5.982
   21    HB2  GLU   4           HB3      GLU   4 -14.187  10.556   6.014
   22    HB3  GLU   4           HB2      GLU   4 -15.279   9.201   5.766
   23    HG2  GLU   4           HG3      GLU   4 -14.386   8.298   7.974
   24    HG3  GLU   4           HG2      GLU   4 -13.697   9.901   8.213
   25    H    LYS   5           H        LYS   5 -14.807   6.946   4.734
   26    HA   LYS   5           HA       LYS   5 -14.630   5.027   6.794
   27    HB2  LYS   5           HB3      LYS   5 -15.499   4.592   3.931
   28    HB3  LYS   5           HB2      LYS   5 -15.886   3.570   5.306
   29    HG2  LYS   5           HG3      LYS   5 -16.797   6.025   6.115
   30    HG3  LYS   5           HG2      LYS   5 -17.146   6.025   4.384
   31    HD2  LYS   5           HD3      LYS   5 -17.815   3.525   5.767
   32    HD3  LYS   5           HD2      LYS   5 -18.747   4.928   6.296
   33    HE2  LYS   5           HE3      LYS   5 -20.017   4.764   4.485
   34    HE3  LYS   5           HE2      LYS   5 -18.599   5.005   3.468
   35    HZ1  LYS   5           HZ1      LYS   5 -20.123   2.668   3.825
   36    HZ2  LYS   5           HZ2      LYS   5 -18.545   2.369   4.356
   37    HZ3  LYS   5           HZ3      LYS   5 -18.815   2.927   2.782
   38    H    GLY   6           H        GLY   6 -12.958   5.393   3.713
   39    HA2  GLY   6           HA3      GLY   6 -11.689   2.879   3.653
   40    HA3  GLY   6           HA2      GLY   6 -11.126   4.328   2.836
   41    H    LYS   7           H        LYS   7 -10.675   5.971   5.028
   42    HA   LYS   7           HA       LYS   7  -8.082   5.253   5.682
   43    HB2  LYS   7           HB3      LYS   7  -8.491   7.522   5.900
   44    HB3  LYS   7           HB2      LYS   7 -10.007   7.271   6.757
   45    HG2  LYS   7           HG3      LYS   7  -7.850   6.220   8.313
   46    HG3  LYS   7           HG2      LYS   7  -7.489   7.882   7.836
   47    HD2  LYS   7           HD3      LYS   7 -10.165   7.941   8.576
   48    HD3  LYS   7           HD2      LYS   7  -9.408   6.880   9.765
   49    HE2  LYS   7           HE3      LYS   7  -8.901   8.799  10.817
   50    HE3  LYS   7           HE2      LYS   7  -7.594   8.890   9.636
   51    HZ1  LYS   7           HZ1      LYS   7  -8.520  10.910   9.300
   52    HZ2  LYS   7           HZ2      LYS   7 -10.064  10.430   9.794
   53    HZ3  LYS   7           HZ3      LYS   7  -9.512  10.033   8.245
   54    H    LYS   8           H        LYS   8 -10.843   4.967   7.547
   55    HA   LYS   8           HA       LYS   8  -9.889   3.851   9.959
   56    HB2  LYS   8           HB3      LYS   8 -12.026   4.594  10.252
   57    HB3  LYS   8           HB2      LYS   8 -12.522   4.138   8.629
   58    HG2  LYS   8           HG3      LYS   8 -11.916   1.934  10.500
   59    HG3  LYS   8           HG2      LYS   8 -13.371   2.879  10.817
   60    HD2  LYS   8           HD3      LYS   8 -14.282   2.358   8.693
   61    HD3  LYS   8           HD2      LYS   8 -12.744   1.711   8.116
   62    HE2  LYS   8           HE3      LYS   8 -13.990   0.462  10.510
   63    HE3  LYS   8           HE2      LYS   8 -14.705   0.132   8.931
   64    HZ1  LYS   8           HZ1      LYS   8 -11.824  -0.240   9.519
   65    HZ2  LYS   8           HZ2      LYS   8 -12.675  -0.776   8.160
   66    HZ3  LYS   8           HZ3      LYS   8 -12.968  -1.477   9.670
   67    H    ILE   9           H        ILE   9 -10.992   2.413   6.929
   68    HA   ILE   9           HA       ILE   9 -11.023  -0.268   7.760
   69    HB   ILE   9           HB       ILE   9 -10.818   1.090   5.114
   70   HG12  ILE   9          HG13      ILE   9 -12.662  -1.050   6.204
   71   HG13  ILE   9          HG12      ILE   9 -12.998   0.679   6.222
   72   HG21  ILE   9          HG21      ILE   9 -10.558  -1.895   5.368
   73   HG22  ILE   9          HG22      ILE   9  -9.176  -0.824   5.133
   74   HG23  ILE   9          HG23      ILE   9 -10.442  -0.913   3.908
   75   HD11  ILE   9          HD11      ILE   9 -13.164  -1.261   4.026
   76   HD12  ILE   9          HD12      ILE   9 -12.503   0.318   3.602
   77   HD13  ILE   9          HD13      ILE   9 -14.104   0.199   4.332
   78    H    PHE  10           H        PHE  10  -8.464   1.691   6.287
   79    HA   PHE  10           HA       PHE  10  -6.521  -0.356   6.140
   80    HB2  PHE  10           HB3      PHE  10  -5.930   1.417   4.806
   81    HB3  PHE  10           HB2      PHE  10  -6.516   2.615   5.954
   82    HD1  PHE  10           HD1      PHE  10  -3.671   1.357   4.463
   83    HD2  PHE  10           HD2      PHE  10  -5.136   2.560   8.273
   84    HE1  PHE  10           HE1      PHE  10  -1.364   1.747   5.223
   85    HE2  PHE  10           HE2      PHE  10  -2.830   2.954   9.041
   86    HZ   PHE  10           HZ       PHE  10  -0.941   2.547   7.514
   87    H    VAL  11           H        VAL  11  -7.363   1.971   8.630
   88    HA   VAL  11           HA       VAL  11  -5.193   1.802  10.302
   89    HB   VAL  11           HB       VAL  11  -8.111   2.056  11.018
   90   HG11  VAL  11          HG11      VAL  11  -5.661   2.240  12.748
   91   HG12  VAL  11          HG12      VAL  11  -7.120   1.284  13.006
   92   HG13  VAL  11          HG13      VAL  11  -7.175   3.039  13.172
   93   HG21  VAL  11          HG21      VAL  11  -6.227   3.827   9.862
   94   HG22  VAL  11          HG22      VAL  11  -6.560   4.394  11.499
   95   HG23  VAL  11          HG23      VAL  11  -7.885   4.162  10.357
   96    H    GLN  12           H        GLN  12  -8.066  -0.358  10.358
   97    HA   GLN  12           HA       GLN  12  -6.762  -2.086  12.378
   98    HB2  GLN  12           HB3      GLN  12  -9.103  -3.272  11.121
   99    HB3  GLN  12           HB2      GLN  12  -8.845  -2.842  12.807
  100    HG2  GLN  12           HG3      GLN  12  -9.230  -0.399  11.671
  101    HG3  GLN  12           HG2      GLN  12 -10.286  -1.422  10.697
  102   HE21  GLN  12          HE21      GLN  12 -12.041  -0.232  11.612
  103   HE22  GLN  12          HE22      GLN  12 -12.633  -0.625  13.187
  104    H    LYS  13           H        LYS  13  -7.843  -2.143   9.200
  105    HA   LYS  13           HA       LYS  13  -7.331  -4.096   7.686
  106    HB2  LYS  13           HB3      LYS  13  -6.920  -1.361   7.464
  107    HB3  LYS  13           HB2      LYS  13  -5.424  -2.084   6.898
  108    HG2  LYS  13           HG3      LYS  13  -8.090  -2.075   5.687
  109    HG3  LYS  13           HG2      LYS  13  -6.498  -2.176   4.935
  110    HD2  LYS  13           HD3      LYS  13  -6.406  -4.565   5.786
  111    HD3  LYS  13           HD2      LYS  13  -8.120  -4.394   6.167
  112    HE2  LYS  13           HE3      LYS  13  -6.856  -4.943   3.646
  113    HE3  LYS  13           HE2      LYS  13  -8.565  -4.990   4.073
  114    HZ1  LYS  13           HZ1      LYS  13  -8.744  -2.654   3.622
  115    HZ2  LYS  13           HZ2      LYS  13  -8.058  -3.411   2.275
  116    HZ3  LYS  13           HZ3      LYS  13  -7.083  -2.525   3.334
  117    H    CYS  14           H        CYS  14  -4.619  -2.448   9.170
  118    HA   CYS  14           HA       CYS  14  -2.894  -4.428   9.590
  119    HB2  CYS  14           HB3      CYS  14  -1.544  -4.901   7.657
  120    HB3  CYS  14           HB2      CYS  14  -3.040  -5.636   7.759
  121    H    ALA  15           H        ALA  15  -3.463  -1.433   9.755
  122    HA   ALA  15           HA       ALA  15  -1.347  -0.103   8.573
  123    HB1  ALA  15           HB1      ALA  15  -2.579   0.741  11.182
  124    HB2  ALA  15           HB2      ALA  15  -3.411   0.892   9.635
  125    HB3  ALA  15           HB3      ALA  15  -1.903   1.763   9.914
  126    H    GLN  16           H        GLN  16  -1.437  -1.900  11.563
  127    HA   GLN  16           HA       GLN  16   0.795  -0.907  12.874
  128    HB2  GLN  16           HB3      GLN  16   0.501  -3.846  12.922
  129    HB3  GLN  16           HB2      GLN  16   0.576  -2.697  14.252
  130    HG2  GLN  16           HG3      GLN  16  -1.790  -2.029  13.592
  131    HG3  GLN  16           HG2      GLN  16  -1.796  -3.487  12.598
  132   HE21  GLN  16          HE21      GLN  16  -0.616  -2.693  15.852
  133   HE22  GLN  16          HE22      GLN  16  -1.436  -3.989  16.650
  134    H    CYS  17           H        CYS  17   0.575  -3.140  10.173
  135    HA   CYS  17           HA       CYS  17   3.370  -3.795  10.176
  136    HB2  CYS  17           HB3      CYS  17   1.523  -4.141   7.827
  137    HB3  CYS  17           HB2      CYS  17   2.918  -5.115   8.280
  138    H    HIS  18           H        HIS  18   1.440  -1.241   8.948
  139    HA   HIS  18           HA       HIS  18   3.646  -0.347   7.217
  140    HB2  HIS  18           HB3      HIS  18   0.744   0.493   7.133
  141    HB3  HIS  18           HB2      HIS  18   2.003   0.996   6.010
  142    HD1  HIS  18           HD1      HIS  18   1.716  -0.179   3.864
  143    HD2  HIS  18           HD2      HIS  18   0.776  -2.623   7.088
  144    HE1  HIS  18           HE1      HIS  18   1.108  -2.405   2.865
  145    H    THR  19           H        THR  19   3.155  -0.017  10.199
  146    HA   THR  19           HA       THR  19   3.331   1.582  11.809
  147    HB   THR  19           HB       THR  19   4.784   3.077   9.620
  148    HG1  THR  19           HG1      THR  19   6.608   1.998  10.380
  149   HG21  THR  19          HG21      THR  19   5.241   3.197  12.585
  150   HG22  THR  19          HG22      THR  19   4.321   4.395  11.675
  151   HG23  THR  19          HG23      THR  19   6.034   4.153  11.333
  152    H    VAL  20           H        VAL  20   2.708   3.724  12.516
  153    HA   VAL  20           HA       VAL  20   0.295   4.595  11.180
  154    HB   VAL  20           HB       VAL  20   1.415   5.925  13.621
  155   HG11  VAL  20          HG11      VAL  20  -0.730   6.585  12.297
  156   HG12  VAL  20          HG12      VAL  20  -0.771   6.534  14.059
  157   HG13  VAL  20          HG13      VAL  20  -1.441   5.199  13.122
  158   HG21  VAL  20          HG21      VAL  20   0.408   4.234  15.034
  159   HG22  VAL  20          HG22      VAL  20   1.609   3.492  13.976
  160   HG23  VAL  20          HG23      VAL  20  -0.110   3.322  13.616
  161    H    GLU  21           H        GLU  21   0.848   7.325  12.505
  162    HA   GLU  21           HA       GLU  21   1.554   8.685  10.134
  163    HB2  GLU  21           HB3      GLU  21   1.930  10.285  12.522
  164    HB3  GLU  21           HB2      GLU  21   0.761  10.472  11.223
  165    HG2  GLU  21           HG3      GLU  21  -0.685   8.812  12.290
  166    HG3  GLU  21           HG2      GLU  21   0.486   8.640  13.597
  167    H    LYS  22           H        LYS  22   3.397   9.810   9.561
  168    HA   LYS  22           HA       LYS  22   5.851   8.665  10.083
  169    HB2  LYS  22           HB3      LYS  22   5.158  10.318   8.228
  170    HB3  LYS  22           HB2      LYS  22   5.584  11.578   9.378
  171    HG2  LYS  22           HG3      LYS  22   7.390   9.478   8.210
  172    HG3  LYS  22           HG2      LYS  22   7.453  11.222   7.953
  173    HD2  LYS  22           HD3      LYS  22   7.977   9.773  10.547
  174    HD3  LYS  22           HD2      LYS  22   9.184  10.539   9.513
  175    HE2  LYS  22           HE3      LYS  22   8.252  12.710   9.937
  176    HE3  LYS  22           HE2      LYS  22   6.892  12.004  10.811
  177    HZ1  LYS  22           HZ1      LYS  22   9.389  12.773  11.817
  178    HZ2  LYS  22           HZ2      LYS  22   9.257  11.094  11.994
  179    HZ3  LYS  22           HZ3      LYS  22   8.079  12.108  12.658
  180    H    GLY  23           H        GLY  23   7.088   8.625  11.810
  181    HA2  GLY  23           HA3      GLY  23   8.245  10.483  13.281
  182    HA3  GLY  23           HA2      GLY  23   6.624  10.546  13.963
  183    H    GLY  24           H        GLY  24   6.162   7.683  13.603
  184    HA2  GLY  24           HA3      GLY  24   7.350   6.806  16.077
  185    HA3  GLY  24           HA2      GLY  24   6.240   5.890  15.068
  186    H    LYS  25           H        LYS  25   7.170   4.005  14.604
  187    HA   LYS  25           HA       LYS  25  10.022   3.998  13.869
  188    HB2  LYS  25           HB3      LYS  25   8.858   1.376  14.345
  189    HB3  LYS  25           HB2      LYS  25  10.286   2.116  15.057
  190    HG2  LYS  25           HG3      LYS  25   9.163   2.869  16.880
  191    HG3  LYS  25           HG2      LYS  25   7.648   3.073  16.001
  192    HD2  LYS  25           HD3      LYS  25   8.863   0.461  16.898
  193    HD3  LYS  25           HD2      LYS  25   7.454   1.258  17.603
  194    HE2  LYS  25           HE3      LYS  25   6.125   0.276  16.122
  195    HE3  LYS  25           HE2      LYS  25   7.046   0.983  14.795
  196    HZ1  LYS  25           HZ1      LYS  25   7.084  -1.703  15.824
  197    HZ2  LYS  25           HZ2      LYS  25   8.629  -1.051  15.606
  198    HZ3  LYS  25           HZ3      LYS  25   7.552  -1.120  14.306
  199    H    HIS  26           H        HIS  26  10.690   2.585  12.131
  200    HA   HIS  26           HA       HIS  26   9.089   2.843   9.831
  201    HB2  HIS  26           HB3      HIS  26  10.990   0.746   9.444
  202    HB3  HIS  26           HB2      HIS  26  11.039   2.398   8.838
  203    HD1  HIS  26           HD1      HIS  26  11.775   0.733  12.192
  204    HD2  HIS  26           HD2      HIS  26  13.303   3.620   9.624
  205    HE1  HIS  26           HE1      HIS  26  13.878   1.564  13.291
  206    HE2  HIS  26           HE2      HIS  26  14.734   3.377  11.765
  207    H    LYS  27           H        LYS  27   7.813   1.427   8.723
  208    HA   LYS  27           HA       LYS  27   6.749  -0.793  10.256
  209    HB2  LYS  27           HB3      LYS  27   4.889  -0.680   8.903
  210    HB3  LYS  27           HB2      LYS  27   5.455   0.983   8.815
  211    HG2  LYS  27           HG3      LYS  27   6.794  -0.294   6.755
  212    HG3  LYS  27           HG2      LYS  27   5.172  -0.990   6.723
  213    HD2  LYS  27           HD3      LYS  27   5.618   1.150   5.359
  214    HD3  LYS  27           HD2      LYS  27   4.162   1.076   6.354
  215    HE2  LYS  27           HE3      LYS  27   4.827   2.798   7.602
  216    HE3  LYS  27           HE2      LYS  27   6.425   2.091   7.845
  217    HZ1  LYS  27           HZ1      LYS  27   7.205   3.061   5.856
  218    HZ2  LYS  27           HZ2      LYS  27   6.374   4.288   6.673
  219    HZ3  LYS  27           HZ3      LYS  27   5.649   3.507   5.358
  220    H    THR  28           H        THR  28   6.135  -2.798   8.881
  221    HA   THR  28           HA       THR  28   8.556  -4.028   8.061
  222    HB   THR  28           HB       THR  28   5.933  -5.225   7.309
  223    HG1  THR  28           HG1      THR  28   6.762  -5.249   9.999
  224   HG21  THR  28          HG21      THR  28   6.877  -7.246   7.893
  225   HG22  THR  28          HG22      THR  28   8.067  -6.501   8.961
  226   HG23  THR  28          HG23      THR  28   8.243  -6.363   7.211
  227    H    GLY  29           H        GLY  29   5.788  -2.694   6.325
  228    HA2  GLY  29           HA3      GLY  29   7.389  -2.833   3.855
  229    HA3  GLY  29           HA2      GLY  29   5.720  -3.386   3.849
  230    HA   PRO  30           HA       PRO  30   6.586   1.419   3.081
  231    HB2  PRO  30           HB3      PRO  30   5.508   0.422   0.472
  232    HB3  PRO  30           HB2      PRO  30   6.629   1.752   0.788
  233    HG2  PRO  30           HG3      PRO  30   7.522  -0.603  -0.088
  234    HG3  PRO  30           HG2      PRO  30   8.431   0.332   1.111
  235    HD2  PRO  30           HD3      PRO  30   6.840  -2.147   1.457
  236    HD3  PRO  30           HD2      PRO  30   8.238  -1.562   2.381
  237    H    ASN  31           H        ASN  31   4.941   2.459   3.997
  238    HA   ASN  31           HA       ASN  31   2.385   1.475   4.399
  239    HB2  ASN  31           HB3      ASN  31   3.686   3.588   5.363
  240    HB3  ASN  31           HB2      ASN  31   2.725   4.426   4.148
  241   HD21  ASN  31          HD21      ASN  31   2.060   5.355   6.358
  242   HD22  ASN  31          HD22      ASN  31   0.656   4.641   7.067
  243    H    LEU  32           H        LEU  32   3.269   4.062   2.101
  244    HA   LEU  32           HA       LEU  32   1.791   3.005   0.055
  245    HB2  LEU  32           HB3      LEU  32  -0.106   4.514  -0.207
  246    HB3  LEU  32           HB2      LEU  32  -0.136   3.554   1.261
  247    HG   LEU  32           HG       LEU  32  -0.686   5.683   1.824
  248   HD11  LEU  32          HD11      LEU  32   1.473   5.530   2.762
  249   HD12  LEU  32          HD12      LEU  32   0.046   4.849   3.541
  250   HD13  LEU  32          HD13      LEU  32   0.313   6.591   3.562
  251   HD21  LEU  32          HD21      LEU  32  -0.518   7.664   1.059
  252   HD22  LEU  32          HD22      LEU  32   0.153   6.588  -0.167
  253   HD23  LEU  32          HD23      LEU  32   1.142   7.087   1.206
  254    H    HIS  33           H        HIS  33   3.280   5.712   1.556
  255    HA   HIS  33           HA       HIS  33   3.354   7.643  -0.393
  256    HB2  HIS  33           HB3      HIS  33   4.675   7.179   2.024
  257    HB3  HIS  33           HB2      HIS  33   5.965   7.358   0.841
  258    HD1  HIS  33           HD1      HIS  33   6.614   9.622   1.984
  259    HD2  HIS  33           HD2      HIS  33   2.824   9.548   0.281
  260    HE1  HIS  33           HE1      HIS  33   5.883  12.026   1.865
  261    HE2  HIS  33           HE2      HIS  33   3.554  11.948   0.911
  262    H    GLY  34           H        GLY  34   4.089   7.728  -2.408
  263    HA2  GLY  34           HA3      GLY  34   5.389   7.334  -4.268
  264    HA3  GLY  34           HA2      GLY  34   6.559   6.548  -3.215
  265    H    LEU  35           H        LEU  35   3.371   5.344  -2.997
  266    HA   LEU  35           HA       LEU  35   4.088   2.747  -3.765
  267    HB2  LEU  35           HB3      LEU  35   2.165   3.346  -2.306
  268    HB3  LEU  35           HB2      LEU  35   1.319   3.949  -3.718
  269    HG   LEU  35           HG       LEU  35   1.246   1.723  -4.681
  270   HD11  LEU  35          HD11      LEU  35   2.409  -0.068  -3.947
  271   HD12  LEU  35          HD12      LEU  35   2.286   0.408  -2.253
  272   HD13  LEU  35          HD13      LEU  35   3.478   1.176  -3.300
  273   HD21  LEU  35          HD21      LEU  35   0.268   2.080  -1.875
  274   HD22  LEU  35          HD22      LEU  35  -0.023   0.573  -2.742
  275   HD23  LEU  35          HD23      LEU  35  -0.641   2.093  -3.386
  276    H    PHE  36           H        PHE  36   2.279   5.250  -5.523
  277    HA   PHE  36           HA       PHE  36   2.630   3.678  -7.984
  278    HB2  PHE  36           HB3      PHE  36   0.756   5.987  -7.910
  279    HB3  PHE  36           HB2      PHE  36   0.621   4.458  -8.771
  280    HD1  PHE  36           HD1      PHE  36  -0.420   2.556  -7.764
  281    HD2  PHE  36           HD2      PHE  36   0.130   6.149  -5.550
  282    HE1  PHE  36           HE1      PHE  36  -1.953   1.720  -6.032
  283    HE2  PHE  36           HE2      PHE  36  -1.403   5.318  -3.815
  284    HZ   PHE  36           HZ       PHE  36  -2.446   3.100  -4.054
  285    H    GLY  37           H        GLY  37   4.373   5.775  -6.501
  286    HA2  GLY  37           HA3      GLY  37   4.889   7.422  -8.900
  287    HA3  GLY  37           HA2      GLY  37   5.019   8.070  -7.271
  288    H    ARG  38           H        ARG  38   6.294   5.830  -6.078
  289    HA   ARG  38           HA       ARG  38   8.990   6.273  -7.075
  290    HB2  ARG  38           HB3      ARG  38   7.932   4.904  -4.599
  291    HB3  ARG  38           HB2      ARG  38   9.641   5.003  -5.003
  292    HG2  ARG  38           HG3      ARG  38   9.314   7.527  -5.069
  293    HG3  ARG  38           HG2      ARG  38   7.765   7.226  -4.278
  294    HD2  ARG  38           HD3      ARG  38   8.759   6.983  -2.306
  295    HD3  ARG  38           HD2      ARG  38   9.845   5.756  -2.956
  296    HE   ARG  38           HE       ARG  38  11.455   7.345  -2.708
  297   HH11  ARG  38          HH11      ARG  38   8.522   8.911  -3.743
  298   HH12  ARG  38          HH12      ARG  38   9.249  10.478  -3.869
  299   HH21  ARG  38          HH21      ARG  38  12.423   9.404  -2.867
  300   HH22  ARG  38          HH22      ARG  38  11.467  10.758  -3.370
  301    H    LYS  39           H        LYS  39  10.500   4.323  -7.055
  302    HA   LYS  39           HA       LYS  39   9.734   2.535  -9.023
  303    HB2  LYS  39           HB3      LYS  39  12.082   2.999  -8.436
  304    HB3  LYS  39           HB2      LYS  39  11.874   2.113  -6.931
  305    HG2  LYS  39           HG3      LYS  39  12.836   1.062  -9.251
  306    HG3  LYS  39           HG2      LYS  39  12.141   0.125  -7.928
  307    HD2  LYS  39           HD3      LYS  39  11.160  -0.516 -10.068
  308    HD3  LYS  39           HD2      LYS  39   9.950   0.222  -9.018
  309    HE2  LYS  39           HE3      LYS  39  10.526   2.404 -10.230
  310    HE3  LYS  39           HE2      LYS  39  11.298   1.374 -11.433
  311    HZ1  LYS  39           HZ1      LYS  39   9.321   0.581 -12.157
  312    HZ2  LYS  39           HZ2      LYS  39   8.768   2.076 -11.591
  313    HZ3  LYS  39           HZ3      LYS  39   8.574   0.689 -10.642
  314    H    THR  40           H        THR  40  10.866   0.924  -6.157
  315    HA   THR  40           HA       THR  40   8.281  -0.010  -5.347
  316    HB   THR  40           HB       THR  40   8.780  -2.278  -5.120
  317    HG1  THR  40           HG1      THR  40  10.260  -3.473  -6.024
  318   HG21  THR  40          HG21      THR  40   8.458  -2.036  -7.871
  319   HG22  THR  40          HG22      THR  40   8.744  -2.873  -6.660
  320   HG23  THR  40          HG23      THR  40   7.353  -2.891  -6.357
  321    H    GLY  41           H        GLY  41   8.225   0.443  -3.553
  322    HA2  GLY  41           HA3      GLY  41   8.732   0.489  -1.314
  323    HA3  GLY  41           HA2      GLY  41   9.390  -1.117  -1.579
  324    H    GLN  42           H        GLN  42  10.598   1.893  -2.981
  325    HA   GLN  42           HA       GLN  42  13.164   1.372  -1.659
  326    HB2  GLN  42           HB3      GLN  42  13.647   3.402  -3.438
  327    HB3  GLN  42           HB2      GLN  42  13.894   1.690  -3.757
  328    HG2  GLN  42           HG3      GLN  42  12.646   2.852  -5.536
  329    HG3  GLN  42           HG2      GLN  42  11.751   1.516  -4.815
  330   HE21  GLN  42          HE21      GLN  42   9.687   2.024  -4.817
  331   HE22  GLN  42          HE22      GLN  42   9.008   3.532  -4.319
  332    H    ALA  43           H        ALA  43  11.244   2.430  -0.000
  333    HA   ALA  43           HA       ALA  43  11.042   5.187   0.189
  334    HB1  ALA  43           HB1      ALA  43  11.167   4.362   2.820
  335    HB2  ALA  43           HB2      ALA  43  10.631   2.921   1.956
  336    HB3  ALA  43           HB3      ALA  43   9.721   4.425   1.814
  337    HA   PRO  44           HA       PRO  44  14.897   6.684   1.725
  338    HB2  PRO  44           HB3      PRO  44  14.283   8.366   3.718
  339    HB3  PRO  44           HB2      PRO  44  13.769   8.678   2.056
  340    HG2  PRO  44           HG3      PRO  44  12.204   7.541   4.340
  341    HG3  PRO  44           HG2      PRO  44  11.709   8.741   3.133
  342    HD2  PRO  44           HD3      PRO  44  11.065   6.074   3.005
  343    HD3  PRO  44           HD2      PRO  44  11.171   7.139   1.589
  344    H    GLY  45           H        GLY  45  14.014   7.261   4.943
  345    HA2  GLY  45           HA3      GLY  45  16.047   5.542   5.956
  346    HA3  GLY  45           HA2      GLY  45  14.917   6.485   6.914
  347    H    PHE  46           H        PHE  46  13.212   4.635   4.743
  348    HA   PHE  46           HA       PHE  46  12.310   2.856   6.828
  349    HB2  PHE  46           HB3      PHE  46  10.689   3.859   5.289
  350    HB3  PHE  46           HB2      PHE  46  11.480   3.071   3.928
  351    HD1  PHE  46           HD1      PHE  46   9.694   2.373   7.102
  352    HD2  PHE  46           HD2      PHE  46  10.841   0.937   3.265
  353    HE1  PHE  46           HE1      PHE  46   8.248   0.406   7.410
  354    HE2  PHE  46           HE2      PHE  46   9.398  -1.033   3.567
  355    HZ   PHE  46           HZ       PHE  46   8.099  -1.301   5.640
  356    H    THR  47           H        THR  47  12.749   0.728   7.051
  357    HA   THR  47           HA       THR  47  14.927  -0.361   5.515
  358    HB   THR  47           HB       THR  47  14.004  -0.722   8.096
  359    HG1  THR  47           HG1      THR  47  15.702  -2.240   8.194
  360   HG21  THR  47          HG21      THR  47  13.675  -3.193   8.236
  361   HG22  THR  47          HG22      THR  47  13.390  -3.188   6.496
  362   HG23  THR  47          HG23      THR  47  12.312  -2.293   7.570
  363    H    TYR  48           H        TYR  48  14.385  -0.906   3.490
  364    HA   TYR  48           HA       TYR  48  11.875  -2.058   2.777
  365    HB2  TYR  48           HB3      TYR  48  13.797  -2.562   0.745
  366    HB3  TYR  48           HB2      TYR  48  12.527  -1.345   0.762
  367    HD1  TYR  48           HD1      TYR  48  15.971  -1.915   2.093
  368    HD2  TYR  48           HD2      TYR  48  13.136   0.884   0.601
  369    HE1  TYR  48           HE1      TYR  48  17.683  -0.152   2.167
  370    HE2  TYR  48           HE2      TYR  48  14.840   2.655   0.670
  371    HH   TYR  48           HH       TYR  48  17.954   2.152   2.158
  372    H    THR  49           H        THR  49  11.598  -4.118   1.723
  373    HA   THR  49           HA       THR  49  12.878  -6.253   3.180
  374    HB   THR  49           HB       THR  49  11.273  -7.701   2.118
  375    HG1  THR  49           HG1      THR  49   9.824  -6.657   0.522
  376   HG21  THR  49          HG21      THR  49   9.366  -5.541   2.266
  377   HG22  THR  49          HG22      THR  49  10.477  -5.535   3.636
  378   HG23  THR  49          HG23      THR  49   9.531  -6.978   3.274
  379    H    ASP  50           H        ASP  50  13.542  -8.257   1.809
  380    HA   ASP  50           HA       ASP  50  15.804  -7.607   0.345
  381    HB2  ASP  50           HB3      ASP  50  15.845  -9.807   1.038
  382    HB3  ASP  50           HB2      ASP  50  14.151 -10.074   0.638
  383    H    ALA  51           H        ALA  51  12.491  -8.102  -0.713
  384    HA   ALA  51           HA       ALA  51  13.049  -8.080  -3.506
  385    HB1  ALA  51           HB1      ALA  51  10.926  -8.717  -3.604
  386    HB2  ALA  51           HB2      ALA  51  10.401  -7.156  -2.976
  387    HB3  ALA  51           HB3      ALA  51  10.786  -8.470  -1.864
  388    H    ASN  52           H        ASN  52  11.957  -5.596  -1.207
  389    HA   ASN  52           HA       ASN  52  11.633  -3.514  -3.058
  390    HB2  ASN  52           HB3      ASN  52  12.368  -3.398  -0.127
  391    HB3  ASN  52           HB2      ASN  52  11.873  -2.007  -1.088
  392   HD21  ASN  52          HD21      ASN  52  10.080  -4.108  -2.516
  393   HD22  ASN  52          HD22      ASN  52   8.681  -4.157  -1.503
  394    H    LYS  53           H        LYS  53  14.440  -4.489  -1.129
  395    HA   LYS  53           HA       LYS  53  16.166  -2.421  -1.883
  396    HB2  LYS  53           HB3      LYS  53  17.990  -4.105  -1.351
  397    HB3  LYS  53           HB2      LYS  53  16.831  -3.789  -0.066
  398    HG2  LYS  53           HG3      LYS  53  15.700  -5.846  -0.476
  399    HG3  LYS  53           HG2      LYS  53  16.638  -6.129  -1.944
  400    HD2  LYS  53           HD3      LYS  53  17.793  -7.457  -0.484
  401    HD3  LYS  53           HD2      LYS  53  18.668  -5.942  -0.264
  402    HE2  LYS  53           HE3      LYS  53  18.168  -5.983   1.896
  403    HE3  LYS  53           HE2      LYS  53  16.454  -5.894   1.492
  404    HZ1  LYS  53           HZ1      LYS  53  17.974  -8.107   2.468
  405    HZ2  LYS  53           HZ2      LYS  53  17.118  -8.508   1.065
  406    HZ3  LYS  53           HZ3      LYS  53  16.296  -7.894   2.411
  407    H    ASN  54           H        ASN  54  15.188  -5.350  -3.496
  408    HA   ASN  54           HA       ASN  54  17.217  -5.248  -5.523
  409    HB2  ASN  54           HB3      ASN  54  14.588  -6.748  -5.470
  410    HB3  ASN  54           HB2      ASN  54  15.893  -7.012  -6.621
  411   HD21  ASN  54          HD21      ASN  54  17.262  -6.229  -3.737
  412   HD22  ASN  54          HD22      ASN  54  17.545  -7.815  -3.112
  413    H    LYS  55           H        LYS  55  14.289  -3.634  -4.939
  414    HA   LYS  55           HA       LYS  55  13.247  -1.955  -6.079
  415    HB2  LYS  55           HB3      LYS  55  15.533  -2.431  -7.980
  416    HB3  LYS  55           HB2      LYS  55  14.258  -1.274  -8.335
  417    HG2  LYS  55           HG3      LYS  55  15.077   0.244  -6.918
  418    HG3  LYS  55           HG2      LYS  55  15.422  -0.961  -5.675
  419    HD2  LYS  55           HD3      LYS  55  17.111  -0.166  -8.032
  420    HD3  LYS  55           HD2      LYS  55  17.520  -0.098  -6.316
  421    HE2  LYS  55           HE3      LYS  55  17.137  -2.682  -6.433
  422    HE3  LYS  55           HE2      LYS  55  17.422  -2.445  -8.157
  423    HZ1  LYS  55           HZ1      LYS  55  19.508  -2.911  -7.271
  424    HZ2  LYS  55           HZ2      LYS  55  19.267  -1.944  -5.905
  425    HZ3  LYS  55           HZ3      LYS  55  19.511  -1.225  -7.417
  426    H    GLY  56           H        GLY  56  11.794  -4.012  -6.098
  427    HA2  GLY  56           HA3      GLY  56  11.360  -5.525  -8.378
  428    HA3  GLY  56           HA2      GLY  56  10.115  -5.103  -7.214
  429    H    ILE  57           H        ILE  57   8.528  -3.741  -7.827
  430    HA   ILE  57           HA       ILE  57   8.996  -1.942 -10.047
  431    HB   ILE  57           HB       ILE  57   7.855  -4.361 -10.617
  432   HG12  ILE  57          HG13      ILE  57   8.714  -3.244 -12.393
  433   HG13  ILE  57          HG12      ILE  57   7.010  -2.904 -12.673
  434   HG21  ILE  57          HG21      ILE  57   5.777  -4.006  -9.597
  435   HG22  ILE  57          HG22      ILE  57   5.512  -3.650 -11.302
  436   HG23  ILE  57          HG23      ILE  57   5.703  -2.333 -10.148
  437   HD11  ILE  57          HD11      ILE  57   7.231  -0.721 -12.151
  438   HD12  ILE  57          HD12      ILE  57   8.889  -1.025 -12.672
  439   HD13  ILE  57          HD13      ILE  57   8.490  -1.023 -10.952
  440    H    THR  58           H        THR  58   7.000  -0.571 -10.491
  441    HA   THR  58           HA       THR  58   6.135   0.516  -7.978
  442    HB   THR  58           HB       THR  58   6.560   1.511 -10.567
  443    HG1  THR  58           HG1      THR  58   6.076   3.495  -9.522
  444   HG21  THR  58          HG21      THR  58   4.200   0.971 -11.083
  445   HG22  THR  58          HG22      THR  58   4.562   2.696 -11.135
  446   HG23  THR  58          HG23      THR  58   3.710   2.016  -9.749
  447    H    TRP  59           H        TRP  59   4.478  -0.250  -6.937
  448    HA   TRP  59           HA       TRP  59   2.525  -1.973  -8.040
  449    HB2  TRP  59           HB3      TRP  59   1.864  -0.548  -5.533
  450    HB3  TRP  59           HB2      TRP  59   1.855  -2.274  -5.886
  451    HD1  TRP  59           HD1      TRP  59   4.302   0.545  -4.915
  452    HE1  TRP  59           HE1      TRP  59   6.361  -0.522  -3.801
  453    HE3  TRP  59           HE3      TRP  59   3.146  -4.385  -5.620
  454    HZ2  TRP  59           HZ2      TRP  59   7.362  -3.109  -3.285
  455    HZ3  TRP  59           HZ3      TRP  59   4.709  -6.094  -4.785
  456    HH2  TRP  59           HH2      TRP  59   6.773  -5.467  -3.642
  457    H    LYS  60           H        LYS  60   1.101  -1.317  -9.494
  458    HA   LYS  60           HA       LYS  60  -0.127   1.335  -9.219
  459    HB2  LYS  60           HB3      LYS  60   0.188   1.454 -11.427
  460    HB3  LYS  60           HB2      LYS  60   0.794  -0.195 -11.457
  461    HG2  LYS  60           HG3      LYS  60  -0.945  -0.533 -12.829
  462    HG3  LYS  60           HG2      LYS  60  -1.859  -0.663 -11.326
  463    HD2  LYS  60           HD3      LYS  60  -2.976   1.242 -11.712
  464    HD3  LYS  60           HD2      LYS  60  -1.525   2.086 -12.258
  465    HE2  LYS  60           HE3      LYS  60  -2.190   0.142 -14.211
  466    HE3  LYS  60           HE2      LYS  60  -3.662   1.023 -13.808
  467    HZ1  LYS  60           HZ1      LYS  60  -1.748   1.853 -15.538
  468    HZ2  LYS  60           HZ2      LYS  60  -1.380   2.730 -14.141
  469    HZ3  LYS  60           HZ3      LYS  60  -2.920   2.843 -14.827
  470    H    GLU  61           H        GLU  61  -2.485   1.371 -10.050
  471    HA   GLU  61           HA       GLU  61  -4.056  -0.121  -8.269
  472    HB2  GLU  61           HB3      GLU  61  -4.454   2.049  -9.946
  473    HB3  GLU  61           HB2      GLU  61  -5.516   0.816 -10.611
  474    HG2  GLU  61           HG3      GLU  61  -5.790   0.836  -7.777
  475    HG3  GLU  61           HG2      GLU  61  -5.948   2.484  -8.383
  476    H    GLU  62           H        GLU  62  -3.859  -0.391 -11.824
  477    HA   GLU  62           HA       GLU  62  -5.444  -2.704 -12.018
  478    HB2  GLU  62           HB3      GLU  62  -4.969  -2.672 -14.267
  479    HB3  GLU  62           HB2      GLU  62  -4.606  -1.008 -13.836
  480    HG2  GLU  62           HG3      GLU  62  -2.219  -1.627 -13.639
  481    HG3  GLU  62           HG2      GLU  62  -2.629  -3.246 -14.203
  482    H    THR  63           H        THR  63  -1.929  -2.297 -11.812
  483    HA   THR  63           HA       THR  63  -1.257  -5.010 -12.157
  484    HB   THR  63           HB       THR  63   0.118  -2.591 -11.698
  485    HG1  THR  63           HG1      THR  63   1.433  -3.653 -12.919
  486   HG21  THR  63          HG21      THR  63   1.628  -2.905 -10.000
  487   HG22  THR  63          HG22      THR  63   1.334  -4.643  -9.914
  488   HG23  THR  63          HG23      THR  63   0.142  -3.514  -9.274
  489    H    LEU  64           H        LEU  64  -2.358  -3.185  -9.421
  490    HA   LEU  64           HA       LEU  64  -1.592  -5.058  -7.415
  491    HB2  LEU  64           HB3      LEU  64  -3.062  -2.543  -7.571
  492    HB3  LEU  64           HB2      LEU  64  -3.752  -3.654  -6.402
  493    HG   LEU  64           HG       LEU  64  -0.908  -2.644  -6.434
  494   HD11  LEU  64          HD11      LEU  64  -1.991  -0.882  -5.512
  495   HD12  LEU  64          HD12      LEU  64  -1.892  -1.894  -4.070
  496   HD13  LEU  64          HD13      LEU  64  -3.378  -1.852  -5.016
  497   HD21  LEU  64          HD21      LEU  64  -0.594  -3.869  -4.385
  498   HD22  LEU  64          HD22      LEU  64  -1.106  -4.984  -5.652
  499   HD23  LEU  64          HD23      LEU  64  -2.260  -4.448  -4.432
  500    H    MET  65           H        MET  65  -4.423  -4.572  -9.428
  501    HA   MET  65           HA       MET  65  -6.215  -6.259  -8.085
  502    HB2  MET  65           HB3      MET  65  -5.972  -5.482 -10.989
  503    HB3  MET  65           HB2      MET  65  -7.277  -6.497 -10.393
  504    HG2  MET  65           HG3      MET  65  -6.681  -3.644  -9.668
  505    HG3  MET  65           HG2      MET  65  -8.097  -4.279 -10.508
  506    HE1  MET  65           HE1      MET  65  -6.583  -3.147  -7.326
  507    HE2  MET  65           HE2      MET  65  -6.127  -4.825  -7.032
  508    HE3  MET  65           HE3      MET  65  -7.356  -4.053  -6.027
  509    H    GLU  66           H        GLU  66  -3.825  -6.929 -10.605
  510    HA   GLU  66           HA       GLU  66  -4.473  -9.730 -10.725
  511    HB2  GLU  66           HB3      GLU  66  -2.252  -9.775 -12.048
  512    HB3  GLU  66           HB2      GLU  66  -3.620  -8.916 -12.742
  513    HG2  GLU  66           HG3      GLU  66  -2.709  -6.801 -12.026
  514    HG3  GLU  66           HG2      GLU  66  -1.380  -7.622 -11.204
  515    H    TYR  67           H        TYR  67  -2.059  -7.713  -9.166
  516    HA   TYR  67           HA       TYR  67  -0.341  -9.735  -8.249
  517    HB2  TYR  67           HB3      TYR  67   0.652  -7.699  -7.963
  518    HB3  TYR  67           HB2      TYR  67  -0.863  -6.899  -7.564
  519    HD1  TYR  67           HD1      TYR  67   2.056  -8.620  -6.253
  520    HD2  TYR  67           HD2      TYR  67  -1.747  -6.990  -5.262
  521    HE1  TYR  67           HE1      TYR  67   2.664  -8.663  -3.871
  522    HE2  TYR  67           HE2      TYR  67  -1.149  -7.026  -2.876
  523    HH   TYR  67           HH       TYR  67   0.689  -7.150  -1.441
  524    H    LEU  68           H        LEU  68  -3.465  -8.725  -7.206
  525    HA   LEU  68           HA       LEU  68  -3.406  -9.562  -4.527
  526    HB2  LEU  68           HB3      LEU  68  -5.600  -9.236  -6.546
  527    HB3  LEU  68           HB2      LEU  68  -5.943  -9.891  -4.957
  528    HG   LEU  68           HG       LEU  68  -4.665  -7.198  -5.427
  529   HD11  LEU  68          HD11      LEU  68  -6.787  -6.203  -5.021
  530   HD12  LEU  68          HD12      LEU  68  -7.520  -7.766  -4.655
  531   HD13  LEU  68          HD13      LEU  68  -7.004  -7.396  -6.301
  532   HD21  LEU  68          HD21      LEU  68  -4.124  -8.150  -3.269
  533   HD22  LEU  68          HD22      LEU  68  -5.493  -7.265  -2.637
  534   HD23  LEU  68          HD23      LEU  68  -5.271  -6.827  -3.069
  535    H    GLU  69           H        GLU  69  -3.301 -11.350  -7.413
  536    HA   GLU  69           HA       GLU  69  -4.628 -13.709  -6.684
  537    HB2  GLU  69           HB3      GLU  69  -3.269 -12.824  -8.905
  538    HB3  GLU  69           HB2      GLU  69  -2.220 -14.104  -8.309
  539    HG2  GLU  69           HG3      GLU  69  -4.074 -15.674  -8.371
  540    HG3  GLU  69           HG2      GLU  69  -5.152 -14.394  -8.924
  541    H    ASN  70           H        ASN  70  -1.105 -13.611  -7.033
  542    HA   ASN  70           HA       ASN  70  -0.898 -15.133  -4.517
  543    HB2  ASN  70           HB3      ASN  70   0.486 -15.460  -7.153
  544    HB3  ASN  70           HB2      ASN  70   1.323 -15.934  -5.677
  545   HD21  ASN  70          HD21      ASN  70  -1.036 -16.759  -7.982
  546   HD22  ASN  70          HD22      ASN  70  -1.559 -18.241  -7.265
  547    HA   PRO  71           HA       PRO  71   1.143 -11.138  -3.544
  548    HB2  PRO  71           HB3      PRO  71   1.148 -12.591  -0.939
  549    HB3  PRO  71           HB2      PRO  71   0.719 -10.912  -1.291
  550    HG2  PRO  71           HG3      PRO  71  -1.173 -12.722  -0.818
  551    HG3  PRO  71           HG2      PRO  71  -1.396 -11.471  -2.055
  552    HD2  PRO  71           HD3      PRO  71  -0.771 -14.370  -2.377
  553    HD3  PRO  71           HD2      PRO  71  -1.758 -13.306  -3.401
  554    H    LYS  72           H        LYS  72   2.082 -14.441  -2.756
  555    HA   LYS  72           HA       LYS  72   4.805 -13.734  -2.150
  556    HB2  LYS  72           HB3      LYS  72   4.804 -15.745  -1.186
  557    HB3  LYS  72           HB2      LYS  72   3.150 -15.976  -1.735
  558    HG2  LYS  72           HG3      LYS  72   4.140 -17.825  -2.625
  559    HG3  LYS  72           HG2      LYS  72   4.331 -16.696  -3.967
  560    HD2  LYS  72           HD3      LYS  72   6.537 -16.402  -2.174
  561    HD3  LYS  72           HD2      LYS  72   6.342 -18.110  -2.576
  562    HE2  LYS  72           HE3      LYS  72   5.994 -16.680  -4.973
  563    HE3  LYS  72           HE2      LYS  72   7.400 -15.977  -4.174
  564    HZ1  LYS  72           HZ1      LYS  72   8.377 -18.170  -4.012
  565    HZ2  LYS  72           HZ2      LYS  72   8.000 -17.826  -5.625
  566    HZ3  LYS  72           HZ3      LYS  72   7.014 -18.869  -4.731
  567    H    LYS  73           H        LYS  73   2.994 -14.577  -4.958
  568    HA   LYS  73           HA       LYS  73   5.145 -15.529  -6.556
  569    HB2  LYS  73           HB3      LYS  73   3.622 -15.637  -8.291
  570    HB3  LYS  73           HB2      LYS  73   2.557 -15.728  -6.895
  571    HG2  LYS  73           HG3      LYS  73   1.427 -14.138  -8.012
  572    HG3  LYS  73           HG2      LYS  73   2.606 -13.068  -7.250
  573    HD2  LYS  73           HD3      LYS  73   2.217 -12.815  -9.772
  574    HD3  LYS  73           HD2      LYS  73   3.886 -12.899  -9.202
  575    HE2  LYS  73           HE3      LYS  73   3.345 -14.291 -11.236
  576    HE3  LYS  73           HE2      LYS  73   4.111 -15.147  -9.898
  577    HZ1  LYS  73           HZ1      LYS  73   1.777 -15.777  -9.214
  578    HZ2  LYS  73           HZ2      LYS  73   2.370 -16.516 -10.617
  579    HZ3  LYS  73           HZ3      LYS  73   1.273 -15.231 -10.735
  580    H    TYR  74           H        TYR  74   3.886 -12.364  -5.797
  581    HA   TYR  74           HA       TYR  74   5.374 -11.040  -7.885
  582    HB2  TYR  74           HB3      TYR  74   3.448 -10.242  -5.785
  583    HB3  TYR  74           HB2      TYR  74   4.636  -9.023  -6.236
  584    HD1  TYR  74           HD1      TYR  74   2.123 -11.340  -7.720
  585    HD2  TYR  74           HD2      TYR  74   4.271  -7.690  -8.109
  586    HE1  TYR  74           HE1      TYR  74   0.772 -10.762  -9.691
  587    HE2  TYR  74           HE2      TYR  74   2.924  -7.101 -10.080
  588    HH   TYR  74           HH       TYR  74   0.673  -9.371 -11.513
  589    H    ILE  75           H        ILE  75   5.616 -11.390  -4.364
  590    HA   ILE  75           HA       ILE  75   8.443 -10.608  -4.568
  591    HB   ILE  75           HB       ILE  75   6.441  -9.621  -2.546
  592   HG12  ILE  75          HG13      ILE  75   6.498  -8.111  -4.324
  593   HG13  ILE  75          HG12      ILE  75   7.682  -7.432  -3.210
  594   HG21  ILE  75          HG21      ILE  75   8.464  -8.555  -1.450
  595   HG22  ILE  75          HG22      ILE  75   9.440  -9.698  -2.372
  596   HG23  ILE  75          HG23      ILE  75   8.258 -10.288  -1.204
  597   HD11  ILE  75          HD11      ILE  75   8.985  -7.338  -5.018
  598   HD12  ILE  75          HD12      ILE  75   8.031  -8.537  -5.893
  599   HD13  ILE  75          HD13      ILE  75   9.242  -9.057  -4.719
  600    HA   PRO  76           HA       PRO  76   7.957 -14.788  -2.581
  601    HB2  PRO  76           HB3      PRO  76  10.654 -15.006  -3.797
  602    HB3  PRO  76           HB2      PRO  76   9.302 -16.143  -3.847
  603    HG2  PRO  76           HG3      PRO  76   9.954 -14.692  -5.990
  604    HG3  PRO  76           HG2      PRO  76   8.260 -15.029  -5.592
  605    HD2  PRO  76           HD3      PRO  76   9.842 -12.525  -5.185
  606    HD3  PRO  76           HD2      PRO  76   8.149 -12.721  -5.685
  607    H    GLY  77           H        GLY  77   8.613 -15.198  -0.558
  608    HA2  GLY  77           HA3      GLY  77  10.369 -15.403   1.081
  609    HA3  GLY  77           HA2      GLY  77  11.135 -13.992   0.370
  610    H    THR  78           H        THR  78   8.266 -12.826   0.257
  611    HA   THR  78           HA       THR  78   8.374 -11.740   2.979
  612    HB   THR  78           HB       THR  78   8.179 -10.474   0.545
  613    HG1  THR  78           HG1      THR  78   7.214  -9.448   3.003
  614   HG21  THR  78          HG21      THR  78   5.741 -11.265   0.522
  615   HG22  THR  78          HG22      THR  78   6.075  -9.561   0.214
  616   HG23  THR  78          HG23      THR  78   5.495 -10.074   1.799
  617    H    LYS  79           H        LYS  79   6.866 -12.199   4.436
  618    HA   LYS  79           HA       LYS  79   4.454 -13.622   3.537
  619    HB2  LYS  79           HB3      LYS  79   6.183 -14.625   5.222
  620    HB3  LYS  79           HB2      LYS  79   5.384 -13.576   6.386
  621    HG2  LYS  79           HG3      LYS  79   4.602 -16.030   6.113
  622    HG3  LYS  79           HG2      LYS  79   3.406 -14.745   6.293
  623    HD2  LYS  79           HD3      LYS  79   2.862 -16.379   4.495
  624    HD3  LYS  79           HD2      LYS  79   3.001 -14.712   3.925
  625    HE2  LYS  79           HE3      LYS  79   4.101 -16.370   2.438
  626    HE3  LYS  79           HE2      LYS  79   5.196 -15.131   3.051
  627    HZ1  LYS  79           HZ1      LYS  79   6.105 -17.422   3.117
  628    HZ2  LYS  79           HZ2      LYS  79   4.919 -17.832   4.250
  629    HZ3  LYS  79           HZ3      LYS  79   6.080 -16.661   4.629
  630    H    MET  80           H        MET  80   2.438 -12.924   4.115
  631    HA   MET  80           HA       MET  80   2.317 -10.271   5.376
  632    HB2  MET  80           HB3      MET  80   0.623 -11.672   3.347
  633    HB3  MET  80           HB2      MET  80  -0.109 -10.435   4.361
  634    HG2  MET  80           HG3      MET  80   2.404  -9.907   2.821
  635    HG3  MET  80           HG2      MET  80   0.813  -9.747   2.080
  636    HE1  MET  80           HE1      MET  80  -0.476  -8.146   2.024
  637    HE2  MET  80           HE2      MET  80   0.081  -6.496   2.304
  638    HE3  MET  80           HE3      MET  80  -1.024  -7.260   3.447
  639    H    ILE  81           H        ILE  81   2.007 -10.459   7.353
  640    HA   ILE  81           HA       ILE  81   0.365 -12.503   8.685
  641    HB   ILE  81           HB       ILE  81   2.454 -10.660   9.850
  642   HG12  ILE  81          HG13      ILE  81   3.371 -13.121  10.360
  643   HG13  ILE  81          HG12      ILE  81   2.458 -13.480   8.898
  644   HG21  ILE  81          HG21      ILE  81   1.430 -12.930  11.421
  645   HG22  ILE  81          HG22      ILE  81   0.307 -11.590  11.187
  646   HG23  ILE  81          HG23      ILE  81   1.879 -11.303  11.932
  647   HD11  ILE  81          HD11      ILE  81   4.510 -13.012   8.022
  648   HD12  ILE  81          HD12      ILE  81   4.887 -11.811   9.259
  649   HD13  ILE  81          HD13      ILE  81   3.764 -11.414   7.957
  650    H    PHE  82           H        PHE  82  -1.498 -11.955   9.631
  651    HA   PHE  82           HA       PHE  82  -3.049 -10.660  10.753
  652    HB2  PHE  82           HB3      PHE  82  -0.964  -9.182  11.320
  653    HB3  PHE  82           HB2      PHE  82  -1.590  -8.135  10.052
  654    HD1  PHE  82           HD1      PHE  82  -2.207  -9.520  13.387
  655    HD2  PHE  82           HD2      PHE  82  -3.606  -6.870  10.365
  656    HE1  PHE  82           HE1      PHE  82  -3.760  -8.505  15.002
  657    HE2  PHE  82           HE2      PHE  82  -5.162  -5.849  11.975
  658    HZ   PHE  82           HZ       PHE  82  -5.240  -6.666  14.297
  659    H    ALA  83           H        ALA  83  -4.715  -9.013  10.140
  660    HA   ALA  83           HA       ALA  83  -5.245  -7.561   8.067
  661    HB1  ALA  83           HB1      ALA  83  -5.959  -9.339   6.238
  662    HB2  ALA  83           HB2      ALA  83  -4.671 -10.271   6.998
  663    HB3  ALA  83           HB3      ALA  83  -4.323  -8.685   6.312
  664    H    GLY  84           H        GLY  84  -6.948  -7.144   9.504
  665    HA2  GLY  84           HA3      GLY  84  -8.964  -9.142  10.009
  666    HA3  GLY  84           HA2      GLY  84  -9.007  -7.462  10.524
  667    H    ILE  85           H        ILE  85  -8.347  -7.888   7.220
  668    HA   ILE  85           HA       ILE  85 -11.180  -7.542   6.511
  669    HB   ILE  85           HB       ILE  85  -8.888  -5.907   5.423
  670   HG12  ILE  85          HG13      ILE  85 -10.426  -5.515   7.711
  671   HG13  ILE  85          HG12      ILE  85  -9.453  -4.302   6.886
  672   HG21  ILE  85          HG21      ILE  85 -11.810  -5.855   4.682
  673   HG22  ILE  85          HG22      ILE  85 -10.502  -6.490   3.683
  674   HG23  ILE  85          HG23      ILE  85 -10.563  -4.769   4.067
  675   HD11  ILE  85          HD11      ILE  85 -11.578  -3.993   5.423
  676   HD12  ILE  85          HD12      ILE  85 -11.491  -3.262   7.026
  677   HD13  ILE  85          HD13      ILE  85 -12.392  -4.759   6.786
  678    H    LYS  86           H        LYS  86 -11.797  -8.337   4.499
  679    HA   LYS  86           HA       LYS  86  -9.807  -9.571   2.784
  680    HB2  LYS  86           HB3      LYS  86 -11.412 -11.682   2.832
  681    HB3  LYS  86           HB2      LYS  86 -10.071 -11.518   3.957
  682    HG2  LYS  86           HG3      LYS  86 -12.346 -10.236   5.082
  683    HG3  LYS  86           HG2      LYS  86 -12.818 -11.843   4.529
  684    HD2  LYS  86           HD3      LYS  86 -11.352 -12.910   5.957
  685    HD3  LYS  86           HD2      LYS  86 -10.284 -11.511   6.073
  686    HE2  LYS  86           HE3      LYS  86 -12.391 -10.416   7.205
  687    HE3  LYS  86           HE2      LYS  86 -12.822 -12.097   7.521
  688    HZ1  LYS  86           HZ1      LYS  86 -10.148 -11.051   8.214
  689    HZ2  LYS  86           HZ2      LYS  86 -10.943 -12.412   8.828
  690    HZ3  LYS  86           HZ3      LYS  86 -11.459 -10.860   9.268
  691    H    LYS  87           H        LYS  87 -13.197  -8.906   3.454
  692    HA   LYS  87           HA       LYS  87 -14.529  -9.491   1.216
  693    HB2  LYS  87           HB3      LYS  87 -14.852  -7.631   3.288
  694    HB3  LYS  87           HB2      LYS  87 -15.044  -6.710   1.802
  695    HG2  LYS  87           HG3      LYS  87 -17.131  -7.435   1.684
  696    HG3  LYS  87           HG2      LYS  87 -16.512  -9.070   1.442
  697    HD2  LYS  87           HD3      LYS  87 -16.345  -9.219   3.974
  698    HD3  LYS  87           HD2      LYS  87 -17.310  -7.742   4.021
  699    HE2  LYS  87           HE3      LYS  87 -18.628  -9.854   4.251
  700    HE3  LYS  87           HE2      LYS  87 -19.137  -8.810   2.923
  701    HZ1  LYS  87           HZ1      LYS  87 -18.847 -11.335   2.531
  702    HZ2  LYS  87           HZ2      LYS  87 -17.200 -10.964   2.417
  703    HZ3  LYS  87           HZ3      LYS  87 -18.304 -10.247   1.356
  704    H    LYS  88           H        LYS  88 -14.055  -9.336  -0.870
  705    HA   LYS  88           HA       LYS  88 -12.008  -7.902  -2.015
  706    HB2  LYS  88           HB3      LYS  88 -13.164  -9.695  -3.188
  707    HB3  LYS  88           HB2      LYS  88 -14.629  -8.725  -3.275
  708    HG2  LYS  88           HG3      LYS  88 -13.638  -7.206  -4.800
  709    HG3  LYS  88           HG2      LYS  88 -12.032  -7.893  -4.540
  710    HD2  LYS  88           HD3      LYS  88 -14.242  -8.830  -6.244
  711    HD3  LYS  88           HD2      LYS  88 -12.500  -9.020  -6.439
  712    HE2  LYS  88           HE3      LYS  88 -13.457 -11.187  -6.090
  713    HE3  LYS  88           HE2      LYS  88 -12.553 -10.742  -4.643
  714    HZ1  LYS  88           HZ1      LYS  88 -15.192 -11.539  -4.784
  715    HZ2  LYS  88           HZ2      LYS  88 -15.243  -9.884  -4.434
  716    HZ3  LYS  88           HZ3      LYS  88 -14.379 -10.933  -3.429
  717    H    THR  89           H        THR  89 -15.331  -6.894  -1.439
  718    HA   THR  89           HA       THR  89 -15.174  -4.454  -2.878
  719    HB   THR  89           HB       THR  89 -17.312  -4.028  -2.110
  720    HG1  THR  89           HG1      THR  89 -17.204  -3.828   0.014
  721   HG21  THR  89          HG21      THR  89 -17.185  -6.966  -1.502
  722   HG22  THR  89          HG22      THR  89 -17.236  -6.300  -3.136
  723   HG23  THR  89          HG23      THR  89 -18.582  -6.028  -2.029
  724    H    GLU  90           H        GLU  90 -14.326  -5.409   0.364
  725    HA   GLU  90           HA       GLU  90 -14.098  -2.754   1.409
  726    HB2  GLU  90           HB3      GLU  90 -12.848  -5.306   2.442
  727    HB3  GLU  90           HB2      GLU  90 -13.052  -3.808   3.339
  728    HG2  GLU  90           HG3      GLU  90 -15.512  -4.965   2.212
  729    HG3  GLU  90           HG2      GLU  90 -14.734  -5.900   3.489
  730    H    ARG  91           H        ARG  91 -11.815  -5.187   0.241
  731    HA   ARG  91           HA       ARG  91  -9.460  -3.702   0.625
  732    HB2  ARG  91           HB3      ARG  91  -9.977  -5.926  -1.291
  733    HB3  ARG  91           HB2      ARG  91  -8.437  -5.084  -1.171
  734    HG2  ARG  91           HG3      ARG  91  -8.869  -5.695   1.423
  735    HG3  ARG  91           HG2      ARG  91  -9.664  -7.065   0.622
  736    HD2  ARG  91           HD3      ARG  91  -7.026  -6.872  -0.669
  737    HD3  ARG  91           HD2      ARG  91  -6.918  -6.593   1.067
  738    HE   ARG  91           HE       ARG  91  -8.238  -8.716   1.114
  739   HH11  ARG  91          HH11      ARG  91  -5.858  -7.777  -1.248
  740   HH12  ARG  91          HH12      ARG  91  -5.318  -9.327  -1.519
  741   HH21  ARG  91          HH21      ARG  91  -7.555 -10.857   0.719
  742   HH22  ARG  91          HH22      ARG  91  -6.298 -11.159  -0.419
  743    H    GLU  92           H        GLU  92 -11.462  -4.134  -2.283
  744    HA   GLU  92           HA       GLU  92  -9.984  -2.475  -3.976
  745    HB2  GLU  92           HB3      GLU  92 -11.833  -4.073  -4.625
  746    HB3  GLU  92           HB2      GLU  92 -12.977  -2.850  -4.087
  747    HG2  GLU  92           HG3      GLU  92 -12.732  -2.722  -6.467
  748    HG3  GLU  92           HG2      GLU  92 -12.029  -1.281  -5.732
  749    H    ASP  93           H        ASP  93 -12.602  -1.734  -1.724
  750    HA   ASP  93           HA       ASP  93 -13.062   0.920  -2.473
  751    HB2  ASP  93           HB3      ASP  93 -14.626  -0.069  -0.995
  752    HB3  ASP  93           HB2      ASP  93 -13.372  -0.528   0.151
  753    H    GLY  94           H        GLY  94 -10.820  -0.428  -0.066
  754    HA2  GLY  94           HA3      GLY  94  -9.770   1.997   0.861
  755    HA3  GLY  94           HA2      GLY  94  -8.934   0.452   0.899
  756    H    ILE  95           H        ILE  95  -8.944   0.043  -1.944
  757    HA   ILE  95           HA       ILE  95  -6.541   1.308  -2.630
  758    HB   ILE  95           HB       ILE  95  -8.515  -0.387  -4.037
  759   HG12  ILE  95          HG13      ILE  95  -5.518  -0.363  -3.696
  760   HG13  ILE  95          HG12      ILE  95  -6.678  -1.424  -2.901
  761   HG21  ILE  95          HG21      ILE  95  -8.371   0.673  -5.989
  762   HG22  ILE  95          HG22      ILE  95  -6.686   0.159  -6.036
  763   HG23  ILE  95          HG23      ILE  95  -7.105   1.749  -5.398
  764   HD11  ILE  95          HD11      ILE  95  -6.347  -1.407  -5.874
  765   HD12  ILE  95          HD12      ILE  95  -7.058  -2.648  -4.842
  766   HD13  ILE  95          HD13      ILE  95  -5.316  -2.375  -4.818
  767    H    ALA  96           H        ALA  96  -9.903   2.096  -3.405
  768    HA   ALA  96           HA       ALA  96  -9.451   4.085  -5.313
  769    HB1  ALA  96           HB1      ALA  96 -11.676   3.232  -4.892
  770    HB2  ALA  96           HB2      ALA  96 -11.661   4.978  -4.639
  771    HB3  ALA  96           HB3      ALA  96 -11.650   3.885  -3.253
  772    H    TYR  97           H        TYR  97  -9.720   4.317  -1.783
  773    HA   TYR  97           HA       TYR  97  -9.303   7.087  -1.574
  774    HB2  TYR  97           HB3      TYR  97 -10.127   5.963   0.351
  775    HB3  TYR  97           HB2      TYR  97  -8.806   4.801   0.333
  776    HD1  TYR  97           HD1      TYR  97  -7.866   5.097   2.465
  777    HD2  TYR  97           HD2      TYR  97  -8.572   8.496   0.005
  778    HE1  TYR  97           HE1      TYR  97  -6.614   6.497   4.052
  779    HE2  TYR  97           HE2      TYR  97  -7.322   9.905   1.585
  780    HH   TYR  97           HH       TYR  97  -5.512   8.547   4.227
  781    H    LEU  98           H        LEU  98  -7.108   4.359  -1.766
  782    HA   LEU  98           HA       LEU  98  -4.707   5.701  -1.175
  783    HB2  LEU  98           HB3      LEU  98  -5.476   3.109  -1.842
  784    HB3  LEU  98           HB2      LEU  98  -4.416   3.590  -3.151
  785    HG   LEU  98           HG       LEU  98  -3.639   3.787  -0.245
  786   HD11  LEU  98          HD11      LEU  98  -2.166   1.746  -1.346
  787   HD12  LEU  98          HD12      LEU  98  -3.776   1.476  -2.016
  788   HD13  LEU  98          HD13      LEU  98  -3.550   1.556  -0.269
  789   HD21  LEU  98          HD21      LEU  98  -2.136   4.012  -2.843
  790   HD22  LEU  98          HD22      LEU  98  -1.345   3.793  -1.282
  791   HD23  LEU  98          HD23      LEU  98  -2.318   5.232  -1.583
  792    H    LYS  99           H        LYS  99  -6.553   5.331  -4.137
  793    HA   LYS  99           HA       LYS  99  -4.642   6.187  -5.984
  794    HB2  LYS  99           HB3      LYS  99  -7.596   6.781  -6.161
  795    HB3  LYS  99           HB2      LYS  99  -6.460   6.580  -7.487
  796    HG2  LYS  99           HG3      LYS  99  -7.407   4.438  -5.596
  797    HG3  LYS  99           HG2      LYS  99  -7.858   4.629  -7.292
  798    HD2  LYS  99           HD3      LYS  99  -6.123   2.874  -6.581
  799    HD3  LYS  99           HD2      LYS  99  -5.232   4.523  -7.620
  800    HE2  LYS  99           HE3      LYS  99  -4.039   3.791  -5.895
  801    HE3  LYS  99           HE2      LYS  99  -5.477   3.939  -4.885
  802    HZ1  LYS  99           HZ1      LYS  99  -4.136   1.611  -5.623
  803    HZ2  LYS  99           HZ2      LYS  99  -5.649   1.566  -6.374
  804    HZ3  LYS  99           HZ3      LYS  99  -5.545   1.750  -4.697
  805    H    LYS 100           H        LYS 100  -6.980   8.047  -4.069
  806    HA   LYS 100           HA       LYS 100  -6.139  10.561  -5.171
  807    HB2  LYS 100           HB3      LYS 100  -8.199  11.011  -4.399
  808    HB3  LYS 100           HB2      LYS 100  -8.186   9.606  -3.345
  809    HG2  LYS 100           HG3      LYS 100  -6.862  10.908  -1.703
  810    HG3  LYS 100           HG2      LYS 100  -7.042  12.323  -2.743
  811    HD2  LYS 100           HD3      LYS 100  -9.210  10.788  -1.321
  812    HD3  LYS 100           HD2      LYS 100  -8.721  12.463  -1.058
  813    HE2  LYS 100           HE3      LYS 100  -9.794  11.497  -3.693
  814    HE3  LYS 100           HE2      LYS 100 -10.847  12.075  -2.403
  815    HZ1  LYS 100           HZ1      LYS 100  -9.410  13.578  -4.283
  816    HZ2  LYS 100           HZ2      LYS 100  -8.807  13.946  -2.746
  817    HZ3  LYS 100           HZ3      LYS 100 -10.456  14.131  -3.074
  818    H    ALA 101           H        ALA 101  -5.490   8.683  -2.309
  819    HA   ALA 101           HA       ALA 101  -4.115  10.522  -0.741
  820    HB1  ALA 101           HB1      ALA 101  -3.340   7.634  -0.796
  821    HB2  ALA 101           HB2      ALA 101  -4.926   8.126  -0.200
  822    HB3  ALA 101           HB3      ALA 101  -3.462   8.732   0.579
  823    H    THR 102           H        THR 102  -3.127   8.773  -3.553
  824    HA   THR 102           HA       THR 102  -0.353   9.659  -3.164
  825    HB   THR 102           HB       THR 102  -0.284   7.392  -3.772
  826    HG1  THR 102           HG1      THR 102   0.852   7.547  -5.536
  827   HG21  THR 102          HG21      THR 102  -2.777   7.957  -5.161
  828   HG22  THR 102          HG22      THR 102  -2.191   6.462  -4.434
  829   HG23  THR 102          HG23      THR 102  -1.687   6.908  -6.065
  830    H    ASN 103           H        ASN 103  -3.282  10.148  -4.813
  831    HA   ASN 103           HA       ASN 103  -2.281  12.565  -5.979
  832    HB2  ASN 103           HB3      ASN 103  -3.663  10.869  -7.992
  833    HB3  ASN 103           HB2      ASN 103  -2.424  12.098  -8.219
  834   HD21  ASN 103          HD21      ASN 103  -3.014   8.785  -7.245
  835   HD22  ASN 103          HD22      ASN 103  -1.415   8.209  -7.554
  836    H    GLU 104           H        GLU 104  -3.768  13.882  -5.218
  837    HA   GLU 104           HA       GLU 104  -6.194  14.423  -6.105
  838    HB2  GLU 104           HB3      GLU 104  -6.360  12.043  -4.328
  839    HB3  GLU 104           HB2      GLU 104  -7.646  13.234  -4.229
  840    HG2  GLU 104           HG3      GLU 104  -6.982  12.493  -6.964
  841    HG3  GLU 104           HG2      GLU 104  -7.531  11.134  -5.984
  842    HHA  HEC 201           HHA      HEC 201   5.199  -5.126   0.497
  843    HHB  HEC 201           HHB      HEC 201  -0.376  -2.408   0.352
  844    HHC  HEC 201           HHC      HEC 201  -1.999  -6.061   5.238
  845    HHD  HEC 201           HHD      HEC 201   4.135  -5.826   6.813
  846   HMA1  HEC 201          HMA1      HEC 201   0.965  -1.115  -1.220
  847   HMA2  HEC 201          HMA2      HEC 201   2.574  -0.284  -0.711
  848   HMA3  HEC 201          HMA3      HEC 201   2.375  -1.550  -1.532
  849   HAA1  HEC 201          HAA1      HEC 201   5.040  -2.996  -1.407
  850   HAA2  HEC 201          HAA2      HEC 201   5.636  -2.364   0.135
  851   HBA1  HEC 201          HBA1      HEC 201   4.168  -0.318  -0.268
  852   HBA2  HEC 201          HBA2      HEC 201   3.895  -0.945  -1.906
  853   HMB1  HEC 201          HMB1      HEC 201  -3.545  -1.889   2.061
  854   HMB2  HEC 201          HMB2      HEC 201  -3.637  -3.171   0.836
  855   HMB3  HEC 201          HMB3      HEC 201  -2.368  -1.922   0.724
  856    HAB  HEC 201           HAB      HEC 201  -3.846  -3.220   4.566
  857   HBB1  HEC 201          HBB1      HEC 201  -5.300  -5.184   2.780
  858   HBB2  HEC 201          HBB2      HEC 201  -4.652  -3.690   2.069
  859   HBB3  HEC 201          HBB3      HEC 201  -5.766  -3.604   3.463
  860   HMC1  HEC 201          HMC1      HEC 201  -0.855  -7.529   8.571
  861   HMC2  HEC 201          HMC2      HEC 201  -1.850  -7.663   6.980
  862   HMC3  HEC 201          HMC3      HEC 201  -0.503  -8.289   7.316
  863    HAC  HEC 201           HAC      HEC 201   3.070  -6.830   8.307
  864   HBC1  HEC 201          HBC1      HEC 201   3.343  -9.218   7.750
  865   HBC2  HEC 201          HBC2      HEC 201   1.691  -9.527   8.322
  866   HBC3  HEC 201          HBC3      HEC 201   2.944  -8.977   9.469
  867   HMD1  HEC 201          HMD1      HEC 201   6.056  -7.031   6.403
  868   HMD2  HEC 201          HMD2      HEC 201   7.203  -5.738   5.998
  869   HMD3  HEC 201          HMD3      HEC 201   7.292  -7.307   5.148
  870   HAD1  HEC 201          HAD1      HEC 201   7.991  -6.319   3.168
  871   HAD2  HEC 201          HAD2      HEC 201   7.586  -4.893   2.198
  872   HBD1  HEC 201          HBD1      HEC 201   7.886  -7.558   1.311
  873   HBD2  HEC 201          HBD2      HEC 201   7.347  -6.154   0.370
  Start of MODEL    2
    1    H1   GLY   1          1H        GLY   1 -19.439   4.077  -0.429
    2    H2   GLY   1          2H        GLY   1 -18.832   3.550  -1.916
    3    H3   GLY   1          3H        GLY   1 -19.002   5.205  -1.613
    4    HA2  GLY   1           HA2      GLY   1 -17.367   3.836   0.323
    5    HA3  GLY   1           HA3      GLY   1 -16.717   3.796  -1.308
    6    H    ASP   2           H        ASP   2 -16.595   5.348   1.542
    7    HA   ASP   2           HA       ASP   2 -16.015   7.903   0.193
    8    HB2  ASP   2           HB3      ASP   2 -16.624   7.591   3.166
    9    HB3  ASP   2           HB2      ASP   2 -16.664   9.069   2.148
   10    H    VAL   3           H        VAL   3 -14.245   9.171   1.063
   11    HA   VAL   3           HA       VAL   3 -11.888   7.672   1.381
   12    HB   VAL   3           HB       VAL   3 -12.579  10.557   1.514
   13   HG11  VAL   3          HG11      VAL   3 -11.249  10.629   3.414
   14   HG12  VAL   3          HG12      VAL   3 -10.095  10.947   2.118
   15   HG13  VAL   3          HG13      VAL   3 -10.188   9.341   2.842
   16   HG21  VAL   3          HG21      VAL   3 -11.827  10.278  -0.569
   17   HG22  VAL   3          HG22      VAL   3 -11.103   8.716  -0.185
   18   HG23  VAL   3          HG23      VAL   3 -10.214  10.204   0.141
   19    H    GLU   4           H        GLU   4 -13.921   9.386   3.717
   20    HA   GLU   4           HA       GLU   4 -12.284   9.100   5.999
   21    HB2  GLU   4           HB3      GLU   4 -14.203  10.568   6.031
   22    HB3  GLU   4           HB2      GLU   4 -15.296   9.213   5.784
   23    HG2  GLU   4           HG3      GLU   4 -14.402   8.309   7.992
   24    HG3  GLU   4           HG2      GLU   4 -13.713   9.912   8.230
   25    H    LYS   5           H        LYS   5 -14.825   6.958   4.751
   26    HA   LYS   5           HA       LYS   5 -14.647   5.038   6.811
   27    HB2  LYS   5           HB3      LYS   5 -15.518   4.604   3.948
   28    HB3  LYS   5           HB2      LYS   5 -15.905   3.582   5.323
   29    HG2  LYS   5           HG3      LYS   5 -16.814   6.037   6.133
   30    HG3  LYS   5           HG2      LYS   5 -17.165   6.038   4.402
   31    HD2  LYS   5           HD3      LYS   5 -17.833   3.537   5.786
   32    HD3  LYS   5           HD2      LYS   5 -18.764   4.941   6.314
   33    HE2  LYS   5           HE3      LYS   5 -20.036   4.777   4.504
   34    HE3  LYS   5           HE2      LYS   5 -18.618   5.018   3.487
   35    HZ1  LYS   5           HZ1      LYS   5 -20.142   2.682   3.845
   36    HZ2  LYS   5           HZ2      LYS   5 -18.564   2.382   4.374
   37    HZ3  LYS   5           HZ3      LYS   5 -18.835   2.941   2.801
   38    H    GLY   6           H        GLY   6 -12.977   5.405   3.729
   39    HA2  GLY   6           HA3      GLY   6 -11.709   2.890   3.668
   40    HA3  GLY   6           HA2      GLY   6 -11.145   4.339   2.852
   41    H    LYS   7           H        LYS   7 -10.693   5.982   5.043
   42    HA   LYS   7           HA       LYS   7  -8.100   5.263   5.696
   43    HB2  LYS   7           HB3      LYS   7  -8.509   7.532   5.914
   44    HB3  LYS   7           HB2      LYS   7 -10.024   7.281   6.772
   45    HG2  LYS   7           HG3      LYS   7  -7.866   6.230   8.327
   46    HG3  LYS   7           HG2      LYS   7  -7.505   7.892   7.850
   47    HD2  LYS   7           HD3      LYS   7 -10.181   7.952   8.591
   48    HD3  LYS   7           HD2      LYS   7  -9.424   6.890   9.780
   49    HE2  LYS   7           HE3      LYS   7  -8.915   8.809  10.831
   50    HE3  LYS   7           HE2      LYS   7  -7.609   8.899   9.650
   51    HZ1  LYS   7           HZ1      LYS   7  -8.535  10.920   9.314
   52    HZ2  LYS   7           HZ2      LYS   7 -10.079  10.440   9.809
   53    HZ3  LYS   7           HZ3      LYS   7  -9.528  10.044   8.261
   54    H    LYS   8           H        LYS   8 -10.860   4.977   7.562
   55    HA   LYS   8           HA       LYS   8  -9.905   3.861   9.974
   56    HB2  LYS   8           HB3      LYS   8 -12.042   4.605  10.268
   57    HB3  LYS   8           HB2      LYS   8 -12.539   4.149   8.644
   58    HG2  LYS   8           HG3      LYS   8 -11.932   1.945  10.515
   59    HG3  LYS   8           HG2      LYS   8 -13.388   2.890  10.833
   60    HD2  LYS   8           HD3      LYS   8 -14.299   2.370   8.710
   61    HD3  LYS   8           HD2      LYS   8 -12.762   1.722   8.132
   62    HE2  LYS   8           HE3      LYS   8 -14.007   0.473  10.526
   63    HE3  LYS   8           HE2      LYS   8 -14.722   0.143   8.947
   64    HZ1  LYS   8           HZ1      LYS   8 -11.841  -0.229   9.534
   65    HZ2  LYS   8           HZ2      LYS   8 -12.694  -0.765   8.175
   66    HZ3  LYS   8           HZ3      LYS   8 -12.986  -1.466   9.685
   67    H    ILE   9           H        ILE   9 -11.010   2.424   6.944
   68    HA   ILE   9           HA       ILE   9 -11.041  -0.257   7.775
   69    HB   ILE   9           HB       ILE   9 -10.837   1.101   5.128
   70   HG12  ILE   9          HG13      ILE   9 -12.681  -1.038   6.219
   71   HG13  ILE   9          HG12      ILE   9 -13.017   0.691   6.237
   72   HG21  ILE   9          HG21      ILE   9 -10.584  -1.920   5.365
   73   HG22  ILE   9          HG22      ILE   9  -9.196  -0.813   5.147
   74   HG23  ILE   9          HG23      ILE   9 -10.463  -0.902   3.923
   75   HD11  ILE   9          HD11      ILE   9 -13.191  -1.285   4.024
   76   HD12  ILE   9          HD12      ILE   9 -12.523   0.329   3.618
   77   HD13  ILE   9          HD13      ILE   9 -14.124   0.211   4.348
   78    H    PHE  10           H        PHE  10  -8.483   1.701   6.301
   79    HA   PHE  10           HA       PHE  10  -6.540  -0.346   6.153
   80    HB2  PHE  10           HB3      PHE  10  -5.949   1.427   4.819
   81    HB3  PHE  10           HB2      PHE  10  -6.534   2.625   5.967
   82    HD1  PHE  10           HD1      PHE  10  -3.690   1.366   4.474
   83    HD2  PHE  10           HD2      PHE  10  -5.153   2.569   8.285
   84    HE1  PHE  10           HE1      PHE  10  -1.383   1.755   5.233
   85    HE2  PHE  10           HE2      PHE  10  -2.847   2.962   9.052
   86    HZ   PHE  10           HZ       PHE  10  -0.958   2.555   7.524
   87    H    VAL  11           H        VAL  11  -7.380   1.980   8.644
   88    HA   VAL  11           HA       VAL  11  -5.210   1.811  10.315
   89    HB   VAL  11           HB       VAL  11  -8.127   2.066  11.032
   90   HG11  VAL  11          HG11      VAL  11  -5.677   2.249  12.760
   91   HG12  VAL  11          HG12      VAL  11  -7.136   1.293  13.019
   92   HG13  VAL  11          HG13      VAL  11  -7.190   3.048  13.186
   93   HG21  VAL  11          HG21      VAL  11  -6.243   3.836   9.875
   94   HG22  VAL  11          HG22      VAL  11  -6.576   4.403  11.512
   95   HG23  VAL  11          HG23      VAL  11  -7.901   4.172  10.370
   96    H    GLN  12           H        GLN  12  -8.037  -0.381  10.306
   97    HA   GLN  12           HA       GLN  12  -6.733  -2.110  12.325
   98    HB2  GLN  12           HB3      GLN  12  -9.075  -3.295  11.069
   99    HB3  GLN  12           HB2      GLN  12  -8.816  -2.865  12.755
  100    HG2  GLN  12           HG3      GLN  12  -9.201  -0.422  11.620
  101    HG3  GLN  12           HG2      GLN  12 -10.258  -1.445  10.646
  102   HE21  GLN  12          HE21      GLN  12 -12.012  -0.254  11.562
  103   HE22  GLN  12          HE22      GLN  12 -12.605  -0.656  13.133
  104    H    LYS  13           H        LYS  13  -7.815  -2.166   9.148
  105    HA   LYS  13           HA       LYS  13  -7.295  -4.066   7.659
  106    HB2  LYS  13           HB3      LYS  13  -6.892  -1.385   7.412
  107    HB3  LYS  13           HB2      LYS  13  -5.397  -2.108   6.845
  108    HG2  LYS  13           HG3      LYS  13  -8.064  -2.098   5.635
  109    HG3  LYS  13           HG2      LYS  13  -6.472  -2.200   4.882
  110    HD2  LYS  13           HD3      LYS  13  -6.371  -4.536   5.759
  111    HD3  LYS  13           HD2      LYS  13  -8.084  -4.364   6.140
  112    HE2  LYS  13           HE3      LYS  13  -6.822  -4.913   3.619
  113    HE3  LYS  13           HE2      LYS  13  -8.531  -4.959   4.046
  114    HZ1  LYS  13           HZ1      LYS  13  -8.709  -2.623   3.596
  115    HZ2  LYS  13           HZ2      LYS  13  -8.024  -3.381   2.249
  116    HZ3  LYS  13           HZ3      LYS  13  -7.049  -2.495   3.307
  117    H    CYS  14           H        CYS  14  -4.591  -2.473   9.116
  118    HA   CYS  14           HA       CYS  14  -2.867  -4.453   9.515
  119    HB2  CYS  14           HB3      CYS  14  -1.508  -4.873   7.627
  120    HB3  CYS  14           HB2      CYS  14  -3.001  -5.607   7.730
  121    H    ALA  15           H        ALA  15  -3.434  -1.458   9.701
  122    HA   ALA  15           HA       ALA  15  -1.319  -0.128   8.518
  123    HB1  ALA  15           HB1      ALA  15  -2.550   0.716  11.127
  124    HB2  ALA  15           HB2      ALA  15  -3.383   0.868   9.581
  125    HB3  ALA  15           HB3      ALA  15  -1.874   1.738   9.859
  126    H    GLN  16           H        GLN  16  -1.408  -1.925  11.508
  127    HA   GLN  16           HA       GLN  16   0.766  -0.922  12.816
  128    HB2  GLN  16           HB3      GLN  16   0.471  -3.860  12.865
  129    HB3  GLN  16           HB2      GLN  16   0.546  -2.712  14.195
  130    HG2  GLN  16           HG3      GLN  16  -1.760  -2.055  13.537
  131    HG3  GLN  16           HG2      GLN  16  -1.767  -3.512  12.543
  132   HE21  GLN  16          HE21      GLN  16  -0.644  -2.708  15.795
  133   HE22  GLN  16          HE22      GLN  16  -1.406  -4.014  16.595
  134    H    CYS  17           H        CYS  17   0.543  -3.154  10.115
  135    HA   CYS  17           HA       CYS  17   3.339  -3.810  10.117
  136    HB2  CYS  17           HB3      CYS  17   1.490  -4.155   7.769
  137    HB3  CYS  17           HB2      CYS  17   2.885  -5.130   8.221
  138    H    HIS  18           H        HIS  18   1.409  -1.255   8.890
  139    HA   HIS  18           HA       HIS  18   3.615  -0.362   7.159
  140    HB2  HIS  18           HB3      HIS  18   0.712   0.479   7.076
  141    HB3  HIS  18           HB2      HIS  18   1.972   0.981   5.953
  142    HD1  HIS  18           HD1      HIS  18   1.683  -0.193   3.806
  143    HD2  HIS  18           HD2      HIS  18   0.744  -2.637   7.031
  144    HE1  HIS  18           HE1      HIS  18   1.074  -2.418   2.807
  145    H    THR  19           H        THR  19   3.125  -0.032  10.141
  146    HA   THR  19           HA       THR  19   3.302   1.567  11.751
  147    HB   THR  19           HB       THR  19   4.754   3.062   9.561
  148    HG1  THR  19           HG1      THR  19   6.579   1.982  10.320
  149   HG21  THR  19          HG21      THR  19   5.192   3.176  12.500
  150   HG22  THR  19          HG22      THR  19   4.271   4.374  11.589
  151   HG23  THR  19          HG23      THR  19   5.984   4.132  11.247
  152    H    VAL  20           H        VAL  20   2.659   3.704  12.431
  153    HA   VAL  20           HA       VAL  20   0.344   4.556  11.098
  154    HB   VAL  20           HB       VAL  20   1.367   5.905  13.537
  155   HG11  VAL  20          HG11      VAL  20  -0.680   6.546  12.216
  156   HG12  VAL  20          HG12      VAL  20  -0.721   6.495  13.978
  157   HG13  VAL  20          HG13      VAL  20  -1.391   5.160  13.042
  158   HG21  VAL  20          HG21      VAL  20   0.458   4.195  14.952
  159   HG22  VAL  20          HG22      VAL  20   1.561   3.472  13.892
  160   HG23  VAL  20          HG23      VAL  20  -0.060   3.283  13.535
  161    H    GLU  21           H        GLU  21   1.340   7.200  12.433
  162    HA   GLU  21           HA       GLU  21   1.603   8.646  10.052
  163    HB2  GLU  21           HB3      GLU  21   1.931  10.255  12.440
  164    HB3  GLU  21           HB2      GLU  21   0.811  10.433  11.142
  165    HG2  GLU  21           HG3      GLU  21  -0.634   8.773  12.209
  166    HG3  GLU  21           HG2      GLU  21   0.537   8.601  13.516
  167    H    LYS  22           H        LYS  22   3.348   9.790   9.477
  168    HA   LYS  22           HA       LYS  22   5.802   8.644   9.997
  169    HB2  LYS  22           HB3      LYS  22   5.107  10.293   8.152
  170    HB3  LYS  22           HB2      LYS  22   5.535  11.557   9.293
  171    HG2  LYS  22           HG3      LYS  22   7.341   9.456   8.124
  172    HG3  LYS  22           HG2      LYS  22   7.403  11.201   7.867
  173    HD2  LYS  22           HD3      LYS  22   7.928   9.751  10.461
  174    HD3  LYS  22           HD2      LYS  22   9.136  10.517   9.426
  175    HE2  LYS  22           HE3      LYS  22   8.204  12.688   9.851
  176    HE3  LYS  22           HE2      LYS  22   6.845  11.983  10.725
  177    HZ1  LYS  22           HZ1      LYS  22   9.342  12.750  11.731
  178    HZ2  LYS  22           HZ2      LYS  22   9.210  11.072  11.907
  179    HZ3  LYS  22           HZ3      LYS  22   8.033  12.087  12.572
  180    H    GLY  23           H        GLY  23   7.040   8.603  11.724
  181    HA2  GLY  23           HA3      GLY  23   8.198  10.461  13.195
  182    HA3  GLY  23           HA2      GLY  23   6.579  10.533  13.882
  183    H    GLY  24           H        GLY  24   6.114   7.661  13.517
  184    HA2  GLY  24           HA3      GLY  24   7.303   6.784  15.991
  185    HA3  GLY  24           HA2      GLY  24   6.192   5.868  14.982
  186    H    LYS  25           H        LYS  25   7.121   3.983  14.517
  187    HA   LYS  25           HA       LYS  25   9.973   3.976  13.781
  188    HB2  LYS  25           HB3      LYS  25   8.809   1.354  14.258
  189    HB3  LYS  25           HB2      LYS  25  10.242   2.120  14.981
  190    HG2  LYS  25           HG3      LYS  25   9.116   2.847  16.792
  191    HG3  LYS  25           HG2      LYS  25   7.610   3.048  15.914
  192    HD2  LYS  25           HD3      LYS  25   8.834   0.434  16.811
  193    HD3  LYS  25           HD2      LYS  25   7.407   1.236  17.516
  194    HE2  LYS  25           HE3      LYS  25   6.077   0.254  16.035
  195    HE3  LYS  25           HE2      LYS  25   6.998   0.961  14.708
  196    HZ1  LYS  25           HZ1      LYS  25   7.035  -1.725  15.736
  197    HZ2  LYS  25           HZ2      LYS  25   8.581  -1.073  15.518
  198    HZ3  LYS  25           HZ3      LYS  25   7.503  -1.142  14.219
  199    H    HIS  26           H        HIS  26  10.692   2.577  12.110
  200    HA   HIS  26           HA       HIS  26   9.091   2.835   9.811
  201    HB2  HIS  26           HB3      HIS  26  10.991   0.738   9.423
  202    HB3  HIS  26           HB2      HIS  26  11.040   2.390   8.817
  203    HD1  HIS  26           HD1      HIS  26  11.777   0.724  12.171
  204    HD2  HIS  26           HD2      HIS  26  13.305   3.611   9.602
  205    HE1  HIS  26           HE1      HIS  26  13.881   1.555  13.269
  206    HE2  HIS  26           HE2      HIS  26  14.736   3.367  11.743
  207    H    LYS  27           H        LYS  27   7.761   1.406   8.635
  208    HA   LYS  27           HA       LYS  27   6.697  -0.818  10.178
  209    HB2  LYS  27           HB3      LYS  27   4.837  -0.700   8.817
  210    HB3  LYS  27           HB2      LYS  27   5.403   0.962   8.729
  211    HG2  LYS  27           HG3      LYS  27   6.742  -0.315   6.668
  212    HG3  LYS  27           HG2      LYS  27   5.119  -1.010   6.637
  213    HD2  LYS  27           HD3      LYS  27   5.565   1.129   5.272
  214    HD3  LYS  27           HD2      LYS  27   4.109   1.056   6.268
  215    HE2  LYS  27           HE3      LYS  27   4.776   2.777   7.517
  216    HE3  LYS  27           HE2      LYS  27   6.373   2.070   7.758
  217    HZ1  LYS  27           HZ1      LYS  27   7.153   3.040   5.769
  218    HZ2  LYS  27           HZ2      LYS  27   6.323   4.267   6.586
  219    HZ3  LYS  27           HZ3      LYS  27   5.597   3.486   5.272
  220    H    THR  28           H        THR  28   6.082  -2.819   8.794
  221    HA   THR  28           HA       THR  28   8.503  -4.050   7.973
  222    HB   THR  28           HB       THR  28   5.880  -5.246   7.222
  223    HG1  THR  28           HG1      THR  28   6.709  -5.270   9.911
  224   HG21  THR  28          HG21      THR  28   6.839  -7.178   7.849
  225   HG22  THR  28          HG22      THR  28   8.014  -6.522   8.873
  226   HG23  THR  28          HG23      THR  28   8.205  -6.295   7.166
  227    H    GLY  29           H        GLY  29   5.734  -2.715   6.238
  228    HA2  GLY  29           HA3      GLY  29   7.334  -2.854   3.768
  229    HA3  GLY  29           HA2      GLY  29   5.665  -3.406   3.762
  230    HA   PRO  30           HA       PRO  30   6.532   1.398   2.995
  231    HB2  PRO  30           HB3      PRO  30   5.442   0.360   0.476
  232    HB3  PRO  30           HB2      PRO  30   6.564   1.690   0.791
  233    HG2  PRO  30           HG3      PRO  30   7.456  -0.666  -0.085
  234    HG3  PRO  30           HG2      PRO  30   8.366   0.269   1.114
  235    HD2  PRO  30           HD3      PRO  30   6.784  -2.168   1.370
  236    HD3  PRO  30           HD2      PRO  30   8.183  -1.583   2.293
  237    H    ASN  31           H        ASN  31   4.888   2.439   3.911
  238    HA   ASN  31           HA       ASN  31   2.332   1.456   4.314
  239    HB2  ASN  31           HB3      ASN  31   3.633   3.568   5.278
  240    HB3  ASN  31           HB2      ASN  31   2.673   4.406   4.064
  241   HD21  ASN  31          HD21      ASN  31   2.008   5.335   6.274
  242   HD22  ASN  31          HD22      ASN  31   0.703   4.602   6.985
  243    H    LEU  32           H        LEU  32   3.204   3.992   2.102
  244    HA   LEU  32           HA       LEU  32   1.727   2.944   0.061
  245    HB2  LEU  32           HB3      LEU  32  -0.170   4.453  -0.202
  246    HB3  LEU  32           HB2      LEU  32  -0.206   3.493   1.267
  247    HG   LEU  32           HG       LEU  32  -1.256   5.622   1.830
  248   HD11  LEU  32          HD11      LEU  32   1.408   5.250   2.771
  249   HD12  LEU  32          HD12      LEU  32  -0.019   4.569   3.550
  250   HD13  LEU  32          HD13      LEU  32   0.248   6.311   3.571
  251   HD21  LEU  32          HD21      LEU  32  -0.483   7.584   1.068
  252   HD22  LEU  32          HD22      LEU  32   0.187   6.508  -0.158
  253   HD23  LEU  32          HD23      LEU  32   1.178   7.026   1.212
  254    H    HIS  33           H        HIS  33   3.216   5.651   1.561
  255    HA   HIS  33           HA       HIS  33   3.290   7.582  -0.387
  256    HB2  HIS  33           HB3      HIS  33   4.612   7.117   2.029
  257    HB3  HIS  33           HB2      HIS  33   5.902   7.296   0.846
  258    HD1  HIS  33           HD1      HIS  33   6.551   9.560   1.988
  259    HD2  HIS  33           HD2      HIS  33   2.761   9.487   0.287
  260    HE1  HIS  33           HE1      HIS  33   5.821  11.964   1.870
  261    HE2  HIS  33           HE2      HIS  33   3.491  11.887   0.917
  262    H    GLY  34           H        GLY  34   4.024   7.667  -2.403
  263    HA2  GLY  34           HA3      GLY  34   5.323   7.272  -4.263
  264    HA3  GLY  34           HA2      GLY  34   6.493   6.487  -3.211
  265    H    LEU  35           H        LEU  35   3.306   5.283  -2.992
  266    HA   LEU  35           HA       LEU  35   4.021   2.686  -3.761
  267    HB2  LEU  35           HB3      LEU  35   2.099   3.286  -2.300
  268    HB3  LEU  35           HB2      LEU  35   1.254   3.893  -3.720
  269    HG   LEU  35           HG       LEU  35   1.179   1.663  -4.675
  270   HD11  LEU  35          HD11      LEU  35   2.358  -0.040  -3.899
  271   HD12  LEU  35          HD12      LEU  35   2.219   0.347  -2.248
  272   HD13  LEU  35          HD13      LEU  35   3.411   1.115  -3.295
  273   HD21  LEU  35          HD21      LEU  35   0.300   2.001  -1.867
  274   HD22  LEU  35          HD22      LEU  35   0.009   0.494  -2.734
  275   HD23  LEU  35          HD23      LEU  35  -0.609   2.014  -3.377
  276    H    PHE  36           H        PHE  36   2.212   5.190  -5.517
  277    HA   PHE  36           HA       PHE  36   2.562   3.617  -7.979
  278    HB2  PHE  36           HB3      PHE  36   0.788   5.917  -7.897
  279    HB3  PHE  36           HB2      PHE  36   0.651   4.379  -8.762
  280    HD1  PHE  36           HD1      PHE  36  -0.372   2.575  -7.708
  281    HD2  PHE  36           HD2      PHE  36   0.162   6.070  -5.541
  282    HE1  PHE  36           HE1      PHE  36  -1.907   1.730  -5.980
  283    HE2  PHE  36           HE2      PHE  36  -1.371   5.239  -3.805
  284    HZ   PHE  36           HZ       PHE  36  -2.414   3.021  -4.044
  285    H    GLY  37           H        GLY  37   4.305   5.714  -6.496
  286    HA2  GLY  37           HA3      GLY  37   4.822   7.361  -8.895
  287    HA3  GLY  37           HA2      GLY  37   4.951   8.005  -7.257
  288    H    ARG  38           H        ARG  38   6.227   5.768  -6.074
  289    HA   ARG  38           HA       ARG  38   8.922   6.210  -7.072
  290    HB2  ARG  38           HB3      ARG  38   7.866   4.842  -4.595
  291    HB3  ARG  38           HB2      ARG  38   9.574   4.941  -5.000
  292    HG2  ARG  38           HG3      ARG  38   9.248   7.464  -5.067
  293    HG3  ARG  38           HG2      ARG  38   7.699   7.164  -4.274
  294    HD2  ARG  38           HD3      ARG  38   8.694   6.920  -2.303
  295    HD3  ARG  38           HD2      ARG  38   9.780   5.694  -2.954
  296    HE   ARG  38           HE       ARG  38  11.390   7.281  -2.706
  297   HH11  ARG  38          HH11      ARG  38   8.457   8.849  -3.739
  298   HH12  ARG  38          HH12      ARG  38   9.184  10.415  -3.866
  299   HH21  ARG  38          HH21      ARG  38  12.358   9.341  -2.865
  300   HH22  ARG  38          HH22      ARG  38  11.403  10.695  -3.368
  301    H    LYS  39           H        LYS  39  10.432   4.260  -7.053
  302    HA   LYS  39           HA       LYS  39   9.665   2.473  -9.021
  303    HB2  LYS  39           HB3      LYS  39  12.013   2.936  -8.434
  304    HB3  LYS  39           HB2      LYS  39  11.806   2.051  -6.930
  305    HG2  LYS  39           HG3      LYS  39  12.767   0.999  -9.250
  306    HG3  LYS  39           HG2      LYS  39  12.088   0.151  -7.884
  307    HD2  LYS  39           HD3      LYS  39  11.106  -0.490 -10.024
  308    HD3  LYS  39           HD2      LYS  39   9.895   0.239  -8.977
  309    HE2  LYS  39           HE3      LYS  39  10.456   2.341 -10.228
  310    HE3  LYS  39           HE2      LYS  39  11.244   1.401 -11.389
  311    HZ1  LYS  39           HZ1      LYS  39   9.266   0.608 -12.112
  312    HZ2  LYS  39           HZ2      LYS  39   8.714   2.103 -11.545
  313    HZ3  LYS  39           HZ3      LYS  39   8.520   0.717 -10.597
  314    H    THR  40           H        THR  40  10.788   0.863  -6.156
  315    HA   THR  40           HA       THR  40   8.230  -0.032  -5.343
  316    HB   THR  40           HB       THR  40   8.711  -2.340  -5.116
  317    HG1  THR  40           HG1      THR  40  10.191  -3.535  -6.020
  318   HG21  THR  40          HG21      THR  40   8.389  -2.098  -7.901
  319   HG22  THR  40          HG22      THR  40   8.675  -2.941  -6.690
  320   HG23  THR  40          HG23      THR  40   7.284  -2.959  -6.387
  321    H    GLY  41           H        GLY  41   8.158   0.381  -3.550
  322    HA2  GLY  41           HA3      GLY  41   8.666   0.427  -1.312
  323    HA3  GLY  41           HA2      GLY  41   9.323  -1.179  -1.577
  324    H    GLN  42           H        GLN  42  10.532   1.830  -2.979
  325    HA   GLN  42           HA       GLN  42  13.099   1.317  -1.654
  326    HB2  GLN  42           HB3      GLN  42  13.580   3.338  -3.438
  327    HB3  GLN  42           HB2      GLN  42  13.827   1.626  -3.757
  328    HG2  GLN  42           HG3      GLN  42  12.579   2.789  -5.535
  329    HG3  GLN  42           HG2      GLN  42  11.684   1.453  -4.814
  330   HE21  GLN  42          HE21      GLN  42   9.620   1.961  -4.814
  331   HE22  GLN  42          HE22      GLN  42   8.941   3.469  -4.317
  332    H    ALA  43           H        ALA  43  11.179   2.367   0.002
  333    HA   ALA  43           HA       ALA  43  10.978   5.123   0.191
  334    HB1  ALA  43           HB1      ALA  43  11.104   4.299   2.822
  335    HB2  ALA  43           HB2      ALA  43  10.567   2.857   1.958
  336    HB3  ALA  43           HB3      ALA  43   9.657   4.362   1.816
  337    HA   PRO  44           HA       PRO  44  14.834   6.620   1.725
  338    HB2  PRO  44           HB3      PRO  44  14.221   8.301   3.719
  339    HB3  PRO  44           HB2      PRO  44  13.708   8.618   2.048
  340    HG2  PRO  44           HG3      PRO  44  12.142   7.477   4.342
  341    HG3  PRO  44           HG2      PRO  44  11.647   8.677   3.135
  342    HD2  PRO  44           HD3      PRO  44  11.002   6.010   3.007
  343    HD3  PRO  44           HD2      PRO  44  11.108   7.076   1.591
  344    H    GLY  45           H        GLY  45  14.015   7.253   4.922
  345    HA2  GLY  45           HA3      GLY  45  16.048   5.532   5.933
  346    HA3  GLY  45           HA2      GLY  45  14.918   6.476   6.892
  347    H    PHE  46           H        PHE  46  13.160   4.612   4.654
  348    HA   PHE  46           HA       PHE  46  12.258   2.834   6.739
  349    HB2  PHE  46           HB3      PHE  46  10.637   3.837   5.200
  350    HB3  PHE  46           HB2      PHE  46  11.427   3.049   3.839
  351    HD1  PHE  46           HD1      PHE  46   9.644   2.360   7.018
  352    HD2  PHE  46           HD2      PHE  46  10.787   0.915   3.177
  353    HE1  PHE  46           HE1      PHE  46   8.196   0.384   7.323
  354    HE2  PHE  46           HE2      PHE  46   9.344  -1.054   3.478
  355    HZ   PHE  46           HZ       PHE  46   8.046  -1.322   5.552
  356    H    THR  47           H        THR  47  12.696   0.706   6.962
  357    HA   THR  47           HA       THR  47  14.855  -0.380   5.424
  358    HB   THR  47           HB       THR  47  13.952  -0.745   8.005
  359    HG1  THR  47           HG1      THR  47  15.650  -2.263   8.103
  360   HG21  THR  47          HG21      THR  47  13.623  -3.215   8.146
  361   HG22  THR  47          HG22      THR  47  13.336  -3.211   6.406
  362   HG23  THR  47          HG23      THR  47  12.260  -2.316   7.480
  363    H    TYR  48           H        TYR  48  14.331  -0.929   3.400
  364    HA   TYR  48           HA       TYR  48  11.821  -2.080   2.687
  365    HB2  TYR  48           HB3      TYR  48  13.731  -2.626   0.745
  366    HB3  TYR  48           HB2      TYR  48  12.461  -1.409   0.762
  367    HD1  TYR  48           HD1      TYR  48  15.916  -1.938   2.002
  368    HD2  TYR  48           HD2      TYR  48  13.072   0.824   0.592
  369    HE1  TYR  48           HE1      TYR  48  17.618  -0.217   2.165
  370    HE2  TYR  48           HE2      TYR  48  14.775   2.590   0.670
  371    HH   TYR  48           HH       TYR  48  17.889   2.087   2.156
  372    H    THR  49           H        THR  49  11.595  -4.126   1.701
  373    HA   THR  49           HA       THR  49  12.875  -6.261   3.158
  374    HB   THR  49           HB       THR  49  11.268  -7.709   2.096
  375    HG1  THR  49           HG1      THR  49   9.819  -6.665   0.501
  376   HG21  THR  49          HG21      THR  49   9.362  -5.548   2.245
  377   HG22  THR  49          HG22      THR  49  10.474  -5.543   3.614
  378   HG23  THR  49          HG23      THR  49   9.527  -6.986   3.253
  379    H    ASP  50           H        ASP  50  13.538  -8.265   1.786
  380    HA   ASP  50           HA       ASP  50  15.798  -7.616   0.321
  381    HB2  ASP  50           HB3      ASP  50  15.839  -9.816   1.014
  382    HB3  ASP  50           HB2      ASP  50  14.145 -10.083   0.615
  383    H    ALA  51           H        ALA  51  12.464  -8.065  -0.751
  384    HA   ALA  51           HA       ALA  51  13.014  -8.068  -3.489
  385    HB1  ALA  51           HB1      ALA  51  10.891  -8.705  -3.587
  386    HB2  ALA  51           HB2      ALA  51  10.367  -7.143  -2.959
  387    HB3  ALA  51           HB3      ALA  51  10.752  -8.458  -1.846
  388    H    ASN  52           H        ASN  52  11.924  -5.584  -1.190
  389    HA   ASN  52           HA       ASN  52  11.600  -3.502  -3.041
  390    HB2  ASN  52           HB3      ASN  52  12.337  -3.386  -0.110
  391    HB3  ASN  52           HB2      ASN  52  11.831  -2.048  -1.096
  392   HD21  ASN  52          HD21      ASN  52  10.047  -4.095  -2.498
  393   HD22  ASN  52          HD22      ASN  52   8.649  -4.144  -1.484
  394    H    LYS  53           H        LYS  53  14.408  -4.478  -1.113
  395    HA   LYS  53           HA       LYS  53  16.123  -2.463  -1.893
  396    HB2  LYS  53           HB3      LYS  53  17.957  -4.095  -1.336
  397    HB3  LYS  53           HB2      LYS  53  16.789  -3.832  -0.076
  398    HG2  LYS  53           HG3      LYS  53  15.668  -5.835  -0.460
  399    HG3  LYS  53           HG2      LYS  53  16.604  -6.118  -1.929
  400    HD2  LYS  53           HD3      LYS  53  17.761  -7.438  -0.488
  401    HD3  LYS  53           HD2      LYS  53  18.635  -5.931  -0.250
  402    HE2  LYS  53           HE3      LYS  53  18.142  -5.947   1.857
  403    HE3  LYS  53           HE2      LYS  53  16.429  -5.858   1.453
  404    HZ1  LYS  53           HZ1      LYS  53  17.948  -8.072   2.428
  405    HZ2  LYS  53           HZ2      LYS  53  17.092  -8.473   1.026
  406    HZ3  LYS  53           HZ3      LYS  53  16.270  -7.859   2.372
  407    H    ASN  54           H        ASN  54  15.154  -5.338  -3.481
  408    HA   ASN  54           HA       ASN  54  17.182  -5.237  -5.508
  409    HB2  ASN  54           HB3      ASN  54  14.552  -6.736  -5.454
  410    HB3  ASN  54           HB2      ASN  54  15.857  -7.000  -6.606
  411   HD21  ASN  54          HD21      ASN  54  17.228  -6.218  -3.723
  412   HD22  ASN  54          HD22      ASN  54  17.510  -7.804  -3.097
  413    H    LYS  55           H        LYS  55  14.255  -3.622  -4.923
  414    HA   LYS  55           HA       LYS  55  13.213  -1.943  -6.062
  415    HB2  LYS  55           HB3      LYS  55  15.498  -2.419  -7.964
  416    HB3  LYS  55           HB2      LYS  55  14.223  -1.262  -8.318
  417    HG2  LYS  55           HG3      LYS  55  15.033   0.202  -6.927
  418    HG3  LYS  55           HG2      LYS  55  15.379  -1.002  -5.684
  419    HD2  LYS  55           HD3      LYS  55  17.067  -0.208  -8.043
  420    HD3  LYS  55           HD2      LYS  55  17.477  -0.140  -6.327
  421    HE2  LYS  55           HE3      LYS  55  17.102  -2.671  -6.417
  422    HE3  LYS  55           HE2      LYS  55  17.387  -2.434  -8.142
  423    HZ1  LYS  55           HZ1      LYS  55  19.473  -2.901  -7.257
  424    HZ2  LYS  55           HZ2      LYS  55  19.233  -1.933  -5.890
  425    HZ3  LYS  55           HZ3      LYS  55  19.476  -1.215  -7.402
  426    H    GLY  56           H        GLY  56  11.787  -4.019  -6.120
  427    HA2  GLY  56           HA3      GLY  56  11.352  -5.532  -8.400
  428    HA3  GLY  56           HA2      GLY  56  10.107  -5.110  -7.236
  429    H    ILE  57           H        ILE  57   8.492  -3.727  -7.808
  430    HA   ILE  57           HA       ILE  57   8.960  -1.928 -10.029
  431    HB   ILE  57           HB       ILE  57   7.818  -4.347 -10.598
  432   HG12  ILE  57          HG13      ILE  57   8.677  -3.230 -12.374
  433   HG13  ILE  57          HG12      ILE  57   6.972  -2.890 -12.654
  434   HG21  ILE  57          HG21      ILE  57   5.741  -3.991  -9.577
  435   HG22  ILE  57          HG22      ILE  57   5.475  -3.636 -11.282
  436   HG23  ILE  57          HG23      ILE  57   5.667  -2.318 -10.127
  437   HD11  ILE  57          HD11      ILE  57   7.194  -0.707 -12.131
  438   HD12  ILE  57          HD12      ILE  57   8.852  -1.011 -12.653
  439   HD13  ILE  57          HD13      ILE  57   8.453  -1.009 -10.933
  440    H    THR  58           H        THR  58   6.959  -0.584 -10.484
  441    HA   THR  58           HA       THR  58   6.101   0.530  -7.957
  442    HB   THR  58           HB       THR  58   6.524   1.525 -10.547
  443    HG1  THR  58           HG1      THR  58   6.034   3.465  -9.523
  444   HG21  THR  58          HG21      THR  58   4.165   0.986 -11.062
  445   HG22  THR  58          HG22      THR  58   4.527   2.711 -11.114
  446   HG23  THR  58          HG23      THR  58   3.675   2.031  -9.727
  447    H    TRP  59           H        TRP  59   4.444  -0.236  -6.916
  448    HA   TRP  59           HA       TRP  59   2.490  -1.958  -8.018
  449    HB2  TRP  59           HB3      TRP  59   1.830  -0.533  -5.511
  450    HB3  TRP  59           HB2      TRP  59   1.821  -2.258  -5.864
  451    HD1  TRP  59           HD1      TRP  59   4.259   0.506  -4.920
  452    HE1  TRP  59           HE1      TRP  59   6.328  -0.508  -3.781
  453    HE3  TRP  59           HE3      TRP  59   3.111  -4.370  -5.599
  454    HZ2  TRP  59           HZ2      TRP  59   7.329  -3.095  -3.265
  455    HZ3  TRP  59           HZ3      TRP  59   4.674  -6.080  -4.765
  456    HH2  TRP  59           HH2      TRP  59   6.739  -5.454  -3.622
  457    H    LYS  60           H        LYS  60   1.093  -1.321  -9.511
  458    HA   LYS  60           HA       LYS  60  -0.134   1.331  -9.235
  459    HB2  LYS  60           HB3      LYS  60   0.180   1.451 -11.444
  460    HB3  LYS  60           HB2      LYS  60   0.785  -0.199 -11.473
  461    HG2  LYS  60           HG3      LYS  60  -0.955  -0.536 -12.845
  462    HG3  LYS  60           HG2      LYS  60  -1.868  -0.666 -11.342
  463    HD2  LYS  60           HD3      LYS  60  -2.985   1.239 -11.727
  464    HD3  LYS  60           HD2      LYS  60  -1.533   2.083 -12.273
  465    HE2  LYS  60           HE3      LYS  60  -2.199   0.139 -14.227
  466    HE3  LYS  60           HE2      LYS  60  -3.672   1.020 -13.822
  467    HZ1  LYS  60           HZ1      LYS  60  -1.758   1.850 -15.553
  468    HZ2  LYS  60           HZ2      LYS  60  -1.389   2.727 -14.156
  469    HZ3  LYS  60           HZ3      LYS  60  -2.929   2.841 -14.842
  470    H    GLU  61           H        GLU  61  -2.459   1.389 -10.051
  471    HA   GLU  61           HA       GLU  61  -4.063  -0.124  -8.283
  472    HB2  GLU  61           HB3      GLU  61  -4.461   2.047  -9.960
  473    HB3  GLU  61           HB2      GLU  61  -5.524   0.814 -10.625
  474    HG2  GLU  61           HG3      GLU  61  -5.797   0.833  -7.790
  475    HG3  GLU  61           HG2      GLU  61  -5.954   2.482  -8.396
  476    H    GLU  62           H        GLU  62  -3.868  -0.393 -11.839
  477    HA   GLU  62           HA       GLU  62  -5.454  -2.707 -12.032
  478    HB2  GLU  62           HB3      GLU  62  -4.980  -2.674 -14.281
  479    HB3  GLU  62           HB2      GLU  62  -4.616  -1.010 -13.851
  480    HG2  GLU  62           HG3      GLU  62  -2.229  -1.630 -13.654
  481    HG3  GLU  62           HG2      GLU  62  -2.639  -3.248 -14.218
  482    H    THR  63           H        THR  63  -1.907  -2.292 -11.787
  483    HA   THR  63           HA       THR  63  -1.236  -5.005 -12.133
  484    HB   THR  63           HB       THR  63   0.082  -2.575 -11.675
  485    HG1  THR  63           HG1      THR  63   1.395  -3.637 -12.897
  486   HG21  THR  63          HG21      THR  63   1.592  -2.889  -9.978
  487   HG22  THR  63          HG22      THR  63   1.298  -4.627  -9.892
  488   HG23  THR  63          HG23      THR  63   0.106  -3.498  -9.251
  489    H    LEU  64           H        LEU  64  -2.335  -3.180  -9.396
  490    HA   LEU  64           HA       LEU  64  -1.569  -5.053  -7.390
  491    HB2  LEU  64           HB3      LEU  64  -3.038  -2.538  -7.545
  492    HB3  LEU  64           HB2      LEU  64  -3.728  -3.649  -6.376
  493    HG   LEU  64           HG       LEU  64  -0.884  -2.639  -6.410
  494   HD11  LEU  64          HD11      LEU  64  -1.966  -0.878  -5.487
  495   HD12  LEU  64          HD12      LEU  64  -1.866  -1.889  -4.045
  496   HD13  LEU  64          HD13      LEU  64  -3.353  -1.847  -4.991
  497   HD21  LEU  64          HD21      LEU  64  -0.569  -3.865  -4.360
  498   HD22  LEU  64          HD22      LEU  64  -1.082  -4.979  -5.627
  499   HD23  LEU  64          HD23      LEU  64  -2.235  -4.443  -4.407
  500    H    MET  65           H        MET  65  -4.400  -4.567  -9.402
  501    HA   MET  65           HA       MET  65  -6.192  -6.253  -8.058
  502    HB2  MET  65           HB3      MET  65  -5.950  -5.476 -10.963
  503    HB3  MET  65           HB2      MET  65  -7.255  -6.490 -10.366
  504    HG2  MET  65           HG3      MET  65  -6.661  -3.646  -9.623
  505    HG3  MET  65           HG2      MET  65  -8.075  -4.272 -10.481
  506    HE1  MET  65           HE1      MET  65  -6.559  -3.141  -7.299
  507    HE2  MET  65           HE2      MET  65  -6.103  -4.819  -7.005
  508    HE3  MET  65           HE3      MET  65  -7.332  -4.047  -6.000
  509    H    GLU  66           H        GLU  66  -3.784  -6.927 -10.580
  510    HA   GLU  66           HA       GLU  66  -4.452  -9.724 -10.700
  511    HB2  GLU  66           HB3      GLU  66  -2.232  -9.770 -12.024
  512    HB3  GLU  66           HB2      GLU  66  -3.600  -8.910 -12.717
  513    HG2  GLU  66           HG3      GLU  66  -2.689  -6.796 -12.001
  514    HG3  GLU  66           HG2      GLU  66  -1.359  -7.617 -11.179
  515    H    TYR  67           H        TYR  67  -2.037  -7.707  -9.141
  516    HA   TYR  67           HA       TYR  67  -0.378  -9.719  -8.227
  517    HB2  TYR  67           HB3      TYR  67   0.615  -7.683  -7.941
  518    HB3  TYR  67           HB2      TYR  67  -0.901  -6.897  -7.582
  519    HD1  TYR  67           HD1      TYR  67   2.020  -8.605  -6.231
  520    HD2  TYR  67           HD2      TYR  67  -1.724  -6.985  -5.237
  521    HE1  TYR  67           HE1      TYR  67   2.629  -8.649  -3.849
  522    HE2  TYR  67           HE2      TYR  67  -1.124  -7.022  -2.852
  523    HH   TYR  67           HH       TYR  67   0.662  -7.110  -1.473
  524    H    LEU  68           H        LEU  68  -3.443  -8.719  -7.181
  525    HA   LEU  68           HA       LEU  68  -3.383  -9.557  -4.502
  526    HB2  LEU  68           HB3      LEU  68  -5.577  -9.230  -6.520
  527    HB3  LEU  68           HB2      LEU  68  -5.920  -9.886  -4.931
  528    HG   LEU  68           HG       LEU  68  -4.642  -7.193  -5.402
  529   HD11  LEU  68          HD11      LEU  68  -6.763  -6.197  -4.994
  530   HD12  LEU  68          HD12      LEU  68  -7.496  -7.760  -4.628
  531   HD13  LEU  68          HD13      LEU  68  -6.981  -7.390  -6.274
  532   HD21  LEU  68          HD21      LEU  68  -4.097  -8.133  -3.271
  533   HD22  LEU  68          HD22      LEU  68  -5.439  -7.220  -2.656
  534   HD23  LEU  68          HD23      LEU  68  -5.246  -6.822  -3.043
  535    H    GLU  69           H        GLU  69  -3.280 -11.345  -7.389
  536    HA   GLU  69           HA       GLU  69  -4.607 -13.704  -6.659
  537    HB2  GLU  69           HB3      GLU  69  -3.249 -12.819  -8.881
  538    HB3  GLU  69           HB2      GLU  69  -2.259 -14.087  -8.287
  539    HG2  GLU  69           HG3      GLU  69  -4.054 -15.669  -8.346
  540    HG3  GLU  69           HG2      GLU  69  -5.132 -14.388  -8.899
  541    H    ASN  70           H        ASN  70  -1.123 -13.598  -7.010
  542    HA   ASN  70           HA       ASN  70  -0.929 -15.092  -4.550
  543    HB2  ASN  70           HB3      ASN  70   0.448 -15.444  -7.131
  544    HB3  ASN  70           HB2      ASN  70   1.291 -15.894  -5.710
  545   HD21  ASN  70          HD21      ASN  70  -1.075 -16.743  -7.960
  546   HD22  ASN  70          HD22      ASN  70  -1.592 -18.200  -7.297
  547    HA   PRO  71           HA       PRO  71   1.114 -11.098  -3.577
  548    HB2  PRO  71           HB3      PRO  71   1.119 -12.551  -0.971
  549    HB3  PRO  71           HB2      PRO  71   0.691 -10.872  -1.323
  550    HG2  PRO  71           HG3      PRO  71  -1.202 -12.681  -0.849
  551    HG3  PRO  71           HG2      PRO  71  -1.425 -11.431  -2.087
  552    HD2  PRO  71           HD3      PRO  71  -0.801 -14.329  -2.409
  553    HD3  PRO  71           HD2      PRO  71  -1.788 -13.265  -3.433
  554    H    LYS  72           H        LYS  72   2.053 -14.397  -2.798
  555    HA   LYS  72           HA       LYS  72   4.775 -13.695  -2.185
  556    HB2  LYS  72           HB3      LYS  72   4.775 -15.706  -1.221
  557    HB3  LYS  72           HB2      LYS  72   3.120 -15.936  -1.769
  558    HG2  LYS  72           HG3      LYS  72   4.110 -17.786  -2.660
  559    HG3  LYS  72           HG2      LYS  72   4.300 -16.656  -4.001
  560    HD2  LYS  72           HD3      LYS  72   6.506 -16.364  -2.210
  561    HD3  LYS  72           HD2      LYS  72   6.311 -18.072  -2.612
  562    HE2  LYS  72           HE3      LYS  72   5.963 -16.641  -5.008
  563    HE3  LYS  72           HE2      LYS  72   7.370 -15.938  -4.210
  564    HZ1  LYS  72           HZ1      LYS  72   8.346 -18.131  -4.048
  565    HZ2  LYS  72           HZ2      LYS  72   7.968 -17.787  -5.661
  566    HZ3  LYS  72           HZ3      LYS  72   6.982 -18.830  -4.767
  567    H    LYS  73           H        LYS  73   2.963 -14.538  -4.992
  568    HA   LYS  73           HA       LYS  73   5.106 -15.518  -6.528
  569    HB2  LYS  73           HB3      LYS  73   3.584 -15.622  -8.271
  570    HB3  LYS  73           HB2      LYS  73   2.519 -15.713  -6.875
  571    HG2  LYS  73           HG3      LYS  73   1.389 -14.122  -7.991
  572    HG3  LYS  73           HG2      LYS  73   2.568 -13.053  -7.229
  573    HD2  LYS  73           HD3      LYS  73   2.178 -12.800  -9.751
  574    HD3  LYS  73           HD2      LYS  73   3.847 -12.884  -9.182
  575    HE2  LYS  73           HE3      LYS  73   3.305 -14.275 -11.216
  576    HE3  LYS  73           HE2      LYS  73   4.072 -15.132  -9.878
  577    HZ1  LYS  73           HZ1      LYS  73   1.738 -15.761  -9.193
  578    HZ2  LYS  73           HZ2      LYS  73   2.330 -16.500 -10.596
  579    HZ3  LYS  73           HZ3      LYS  73   1.233 -15.216 -10.714
  580    H    TYR  74           H        TYR  74   3.849 -12.349  -5.777
  581    HA   TYR  74           HA       TYR  74   5.337 -11.025  -7.865
  582    HB2  TYR  74           HB3      TYR  74   3.412 -10.227  -5.764
  583    HB3  TYR  74           HB2      TYR  74   4.600  -9.009  -6.216
  584    HD1  TYR  74           HD1      TYR  74   2.086 -11.325  -7.699
  585    HD2  TYR  74           HD2      TYR  74   4.235  -7.675  -8.088
  586    HE1  TYR  74           HE1      TYR  74   0.734 -10.747  -9.670
  587    HE2  TYR  74           HE2      TYR  74   2.887  -7.085 -10.059
  588    HH   TYR  74           HH       TYR  74   0.635  -9.355 -11.491
  589    H    ILE  75           H        ILE  75   5.582 -11.367  -4.340
  590    HA   ILE  75           HA       ILE  75   8.407 -10.595  -4.549
  591    HB   ILE  75           HB       ILE  75   6.413  -9.582  -2.581
  592   HG12  ILE  75          HG13      ILE  75   6.463  -8.097  -4.304
  593   HG13  ILE  75          HG12      ILE  75   7.647  -7.419  -3.191
  594   HG21  ILE  75          HG21      ILE  75   8.436  -8.517  -1.485
  595   HG22  ILE  75          HG22      ILE  75   9.411  -9.660  -2.408
  596   HG23  ILE  75          HG23      ILE  75   8.230 -10.250  -1.240
  597   HD11  ILE  75          HD11      ILE  75   8.950  -7.325  -5.000
  598   HD12  ILE  75          HD12      ILE  75   7.995  -8.524  -5.874
  599   HD13  ILE  75          HD13      ILE  75   9.207  -9.043  -4.701
  600    HA   PRO  76           HA       PRO  76   7.927 -14.750  -2.617
  601    HB2  PRO  76           HB3      PRO  76  10.620 -14.980  -3.807
  602    HB3  PRO  76           HB2      PRO  76   9.271 -16.105  -3.884
  603    HG2  PRO  76           HG3      PRO  76   9.917 -14.679  -5.973
  604    HG3  PRO  76           HG2      PRO  76   8.222 -15.015  -5.574
  605    HD2  PRO  76           HD3      PRO  76   9.806 -12.512  -5.167
  606    HD3  PRO  76           HD2      PRO  76   8.112 -12.708  -5.667
  607    H    GLY  77           H        GLY  77   8.583 -15.159  -0.594
  608    HA2  GLY  77           HA3      GLY  77  10.341 -15.366   1.044
  609    HA3  GLY  77           HA2      GLY  77  11.107 -13.955   0.333
  610    H    THR  78           H        THR  78   8.238 -12.788   0.221
  611    HA   THR  78           HA       THR  78   8.348 -11.702   2.943
  612    HB   THR  78           HB       THR  78   8.151 -10.436   0.510
  613    HG1  THR  78           HG1      THR  78   7.188  -9.410   2.968
  614   HG21  THR  78          HG21      THR  78   5.714 -11.227   0.487
  615   HG22  THR  78          HG22      THR  78   6.048  -9.522   0.179
  616   HG23  THR  78          HG23      THR  78   5.468 -10.036   1.764
  617    H    LYS  79           H        LYS  79   6.839 -12.161   4.401
  618    HA   LYS  79           HA       LYS  79   4.427 -13.583   3.502
  619    HB2  LYS  79           HB3      LYS  79   6.157 -14.587   5.187
  620    HB3  LYS  79           HB2      LYS  79   5.359 -13.538   6.351
  621    HG2  LYS  79           HG3      LYS  79   4.576 -15.992   6.079
  622    HG3  LYS  79           HG2      LYS  79   3.380 -14.706   6.259
  623    HD2  LYS  79           HD3      LYS  79   2.835 -16.340   4.461
  624    HD3  LYS  79           HD2      LYS  79   2.974 -14.673   3.891
  625    HE2  LYS  79           HE3      LYS  79   4.073 -16.331   2.404
  626    HE3  LYS  79           HE2      LYS  79   5.168 -15.093   3.016
  627    HZ1  LYS  79           HZ1      LYS  79   6.079 -17.375   3.086
  628    HZ2  LYS  79           HZ2      LYS  79   4.892 -17.794   4.216
  629    HZ3  LYS  79           HZ3      LYS  79   6.052 -16.623   4.594
  630    H    MET  80           H        MET  80   2.520 -13.006   4.104
  631    HA   MET  80           HA       MET  80   2.351 -10.343   5.387
  632    HB2  MET  80           HB3      MET  80   0.654 -11.753   3.355
  633    HB3  MET  80           HB2      MET  80  -0.077 -10.515   4.369
  634    HG2  MET  80           HG3      MET  80   2.435  -9.988   2.828
  635    HG3  MET  80           HG2      MET  80   0.843  -9.826   2.088
  636    HE1  MET  80           HE1      MET  80  -0.445  -8.226   2.032
  637    HE2  MET  80           HE2      MET  80   0.112  -6.576   2.312
  638    HE3  MET  80           HE3      MET  80  -0.992  -7.339   3.455
  639    H    ILE  81           H        ILE  81   1.933 -10.315   7.285
  640    HA   ILE  81           HA       ILE  81   0.290 -12.359   8.617
  641    HB   ILE  81           HB       ILE  81   2.380 -10.516   9.782
  642   HG12  ILE  81          HG13      ILE  81   3.297 -12.978  10.291
  643   HG13  ILE  81          HG12      ILE  81   2.384 -13.336   8.830
  644   HG21  ILE  81          HG21      ILE  81   1.357 -12.787  11.354
  645   HG22  ILE  81          HG22      ILE  81   0.234 -11.446  11.120
  646   HG23  ILE  81          HG23      ILE  81   1.775 -11.163  11.859
  647   HD11  ILE  81          HD11      ILE  81   4.435 -12.869   7.953
  648   HD12  ILE  81          HD12      ILE  81   4.811 -11.676   9.208
  649   HD13  ILE  81          HD13      ILE  81   3.690 -11.270   7.888
  650    H    PHE  82           H        PHE  82  -1.536 -11.885   9.590
  651    HA   PHE  82           HA       PHE  82  -2.988 -10.609  10.715
  652    HB2  PHE  82           HB3      PHE  82  -1.001  -9.113  11.279
  653    HB3  PHE  82           HB2      PHE  82  -1.579  -8.079  10.021
  654    HD1  PHE  82           HD1      PHE  82  -2.145  -9.470  13.348
  655    HD2  PHE  82           HD2      PHE  82  -3.544  -6.819  10.327
  656    HE1  PHE  82           HE1      PHE  82  -3.697  -8.454  14.964
  657    HE2  PHE  82           HE2      PHE  82  -5.116  -5.887  11.895
  658    HZ   PHE  82           HZ       PHE  82  -5.222  -6.698  14.216
  659    H    ALA  83           H        ALA  83  -4.654  -8.962  10.102
  660    HA   ALA  83           HA       ALA  83  -5.186  -7.518   8.025
  661    HB1  ALA  83           HB1      ALA  83  -5.900  -9.287   6.201
  662    HB2  ALA  83           HB2      ALA  83  -4.612 -10.219   6.960
  663    HB3  ALA  83           HB3      ALA  83  -4.264  -8.633   6.274
  664    H    GLY  84           H        GLY  84  -6.887  -7.092   9.467
  665    HA2  GLY  84           HA3      GLY  84  -8.903  -9.089   9.973
  666    HA3  GLY  84           HA2      GLY  84  -8.945  -7.410  10.489
  667    H    ILE  85           H        ILE  85  -8.349  -7.891   7.206
  668    HA   ILE  85           HA       ILE  85 -11.183  -7.544   6.499
  669    HB   ILE  85           HB       ILE  85  -8.891  -5.910   5.410
  670   HG12  ILE  85          HG13      ILE  85 -10.427  -5.518   7.699
  671   HG13  ILE  85          HG12      ILE  85  -9.454  -4.305   6.874
  672   HG21  ILE  85          HG21      ILE  85 -11.812  -5.857   4.671
  673   HG22  ILE  85          HG22      ILE  85 -10.505  -6.492   3.671
  674   HG23  ILE  85          HG23      ILE  85 -10.566  -4.771   4.055
  675   HD11  ILE  85          HD11      ILE  85 -11.580  -3.995   5.412
  676   HD12  ILE  85          HD12      ILE  85 -11.492  -3.265   7.014
  677   HD13  ILE  85          HD13      ILE  85 -12.393  -4.761   6.775
  678    H    LYS  86           H        LYS  86 -11.801  -8.339   4.487
  679    HA   LYS  86           HA       LYS  86  -9.811  -9.573   2.771
  680    HB2  LYS  86           HB3      LYS  86 -11.418 -11.684   2.820
  681    HB3  LYS  86           HB2      LYS  86 -10.076 -11.520   3.944
  682    HG2  LYS  86           HG3      LYS  86 -12.350 -10.238   5.070
  683    HG3  LYS  86           HG2      LYS  86 -12.823 -11.845   4.518
  684    HD2  LYS  86           HD3      LYS  86 -11.356 -12.912   5.945
  685    HD3  LYS  86           HD2      LYS  86 -10.288 -11.514   6.060
  686    HE2  LYS  86           HE3      LYS  86 -12.394 -10.418   7.193
  687    HE3  LYS  86           HE2      LYS  86 -12.825 -12.099   7.509
  688    HZ1  LYS  86           HZ1      LYS  86 -10.151 -11.054   8.201
  689    HZ2  LYS  86           HZ2      LYS  86 -10.946 -12.415   8.816
  690    HZ3  LYS  86           HZ3      LYS  86 -11.461 -10.863   9.256
  691    H    LYS  87           H        LYS  87 -13.202  -8.908   3.443
  692    HA   LYS  87           HA       LYS  87 -14.535  -9.492   1.206
  693    HB2  LYS  87           HB3      LYS  87 -14.856  -7.632   3.278
  694    HB3  LYS  87           HB2      LYS  87 -15.048  -6.711   1.792
  695    HG2  LYS  87           HG3      LYS  87 -17.136  -7.435   1.675
  696    HG3  LYS  87           HG2      LYS  87 -16.517  -9.070   1.432
  697    HD2  LYS  87           HD3      LYS  87 -16.349  -9.220   3.964
  698    HD3  LYS  87           HD2      LYS  87 -17.314  -7.742   4.012
  699    HE2  LYS  87           HE3      LYS  87 -18.632  -9.854   4.242
  700    HE3  LYS  87           HE2      LYS  87 -19.142  -8.810   2.914
  701    HZ1  LYS  87           HZ1      LYS  87 -18.853 -11.335   2.522
  702    HZ2  LYS  87           HZ2      LYS  87 -17.205 -10.965   2.408
  703    HZ3  LYS  87           HZ3      LYS  87 -18.309 -10.247   1.347
  704    H    LYS  88           H        LYS  88 -14.061  -9.337  -0.881
  705    HA   LYS  88           HA       LYS  88 -12.015  -7.904  -2.026
  706    HB2  LYS  88           HB3      LYS  88 -13.172  -9.696  -3.199
  707    HB3  LYS  88           HB2      LYS  88 -14.636  -8.726  -3.286
  708    HG2  LYS  88           HG3      LYS  88 -13.646  -7.207  -4.811
  709    HG3  LYS  88           HG2      LYS  88 -12.039  -7.894  -4.552
  710    HD2  LYS  88           HD3      LYS  88 -14.251  -8.830  -6.255
  711    HD3  LYS  88           HD2      LYS  88 -12.509  -9.021  -6.450
  712    HE2  LYS  88           HE3      LYS  88 -13.466 -11.187  -6.101
  713    HE3  LYS  88           HE2      LYS  88 -12.562 -10.743  -4.654
  714    HZ1  LYS  88           HZ1      LYS  88 -15.200 -11.539  -4.795
  715    HZ2  LYS  88           HZ2      LYS  88 -15.251  -9.884  -4.444
  716    HZ3  LYS  88           HZ3      LYS  88 -14.387 -10.934  -3.440
  717    H    THR  89           H        THR  89 -15.337  -6.895  -1.449
  718    HA   THR  89           HA       THR  89 -15.180  -4.454  -2.888
  719    HB   THR  89           HB       THR  89 -17.317  -4.028  -2.119
  720    HG1  THR  89           HG1      THR  89 -17.209  -3.828   0.005
  721   HG21  THR  89          HG21      THR  89 -17.191  -6.966  -1.512
  722   HG22  THR  89          HG22      THR  89 -17.243  -6.300  -3.145
  723   HG23  THR  89          HG23      THR  89 -18.588  -6.027  -2.037
  724    H    GLU  90           H        GLU  90 -14.268  -5.354   0.331
  725    HA   GLU  90           HA       GLU  90 -14.040  -2.700   1.376
  726    HB2  GLU  90           HB3      GLU  90 -12.790  -5.252   2.408
  727    HB3  GLU  90           HB2      GLU  90 -12.993  -3.754   3.305
  728    HG2  GLU  90           HG3      GLU  90 -15.453  -4.910   2.180
  729    HG3  GLU  90           HG2      GLU  90 -14.675  -5.845   3.456
  730    H    ARG  91           H        ARG  91 -11.819  -5.189   0.230
  731    HA   ARG  91           HA       ARG  91  -9.464  -3.704   0.613
  732    HB2  ARG  91           HB3      ARG  91  -9.983  -5.928  -1.303
  733    HB3  ARG  91           HB2      ARG  91  -8.442  -5.086  -1.184
  734    HG2  ARG  91           HG3      ARG  91  -8.874  -5.697   1.410
  735    HG3  ARG  91           HG2      ARG  91  -9.669  -7.067   0.609
  736    HD2  ARG  91           HD3      ARG  91  -7.031  -6.875  -0.682
  737    HD3  ARG  91           HD2      ARG  91  -6.923  -6.596   1.054
  738    HE   ARG  91           HE       ARG  91  -8.244  -8.719   1.100
  739   HH11  ARG  91          HH11      ARG  91  -5.864  -7.780  -1.262
  740   HH12  ARG  91          HH12      ARG  91  -5.325  -9.330  -1.534
  741   HH21  ARG  91          HH21      ARG  91  -7.560 -10.860   0.705
  742   HH22  ARG  91          HH22      ARG  91  -6.304 -11.162  -0.434
  743    H    GLU  92           H        GLU  92 -11.415  -4.121  -2.227
  744    HA   GLU  92           HA       GLU  92  -9.938  -2.462  -3.921
  745    HB2  GLU  92           HB3      GLU  92 -11.787  -4.060  -4.569
  746    HB3  GLU  92           HB2      GLU  92 -12.931  -2.837  -4.030
  747    HG2  GLU  92           HG3      GLU  92 -12.687  -2.708  -6.410
  748    HG3  GLU  92           HG2      GLU  92 -11.983  -1.268  -5.675
  749    H    ASP  93           H        ASP  93 -12.607  -1.736  -1.734
  750    HA   ASP  93           HA       ASP  93 -13.066   0.919  -2.484
  751    HB2  ASP  93           HB3      ASP  93 -14.629  -0.070  -1.005
  752    HB3  ASP  93           HB2      ASP  93 -13.375  -0.529   0.141
  753    H    GLY  94           H        GLY  94 -10.762  -0.374  -0.100
  754    HA2  GLY  94           HA3      GLY  94  -9.728   1.958   0.793
  755    HA3  GLY  94           HA2      GLY  94  -8.891   0.416   0.821
  756    H    ILE  95           H        ILE  95  -8.896   0.055  -1.889
  757    HA   ILE  95           HA       ILE  95  -6.501   1.275  -2.597
  758    HB   ILE  95           HB       ILE  95  -8.468  -0.375  -3.981
  759   HG12  ILE  95          HG13      ILE  95  -5.471  -0.352  -3.642
  760   HG13  ILE  95          HG12      ILE  95  -6.631  -1.413  -2.847
  761   HG21  ILE  95          HG21      ILE  95  -8.325   0.685  -5.933
  762   HG22  ILE  95          HG22      ILE  95  -6.640   0.171  -5.981
  763   HG23  ILE  95          HG23      ILE  95  -7.058   1.760  -5.343
  764   HD11  ILE  95          HD11      ILE  95  -6.301  -1.395  -5.820
  765   HD12  ILE  95          HD12      ILE  95  -7.012  -2.636  -4.787
  766   HD13  ILE  95          HD13      ILE  95  -5.270  -2.364  -4.765
  767    H    ALA  96           H        ALA  96  -9.855   2.108  -3.349
  768    HA   ALA  96           HA       ALA  96  -9.420   4.008  -5.300
  769    HB1  ALA  96           HB1      ALA  96 -11.628   3.245  -4.835
  770    HB2  ALA  96           HB2      ALA  96 -11.629   4.902  -4.624
  771    HB3  ALA  96           HB3      ALA  96 -11.618   3.809  -3.239
  772    H    TYR  97           H        TYR  97  -9.687   4.240  -1.770
  773    HA   TYR  97           HA       TYR  97  -9.270   7.010  -1.561
  774    HB2  TYR  97           HB3      TYR  97 -10.093   5.886   0.364
  775    HB3  TYR  97           HB2      TYR  97  -8.773   4.724   0.346
  776    HD1  TYR  97           HD1      TYR  97  -7.825   5.044   2.424
  777    HD2  TYR  97           HD2      TYR  97  -8.537   8.418   0.019
  778    HE1  TYR  97           HE1      TYR  97  -6.568   6.460   3.973
  779    HE2  TYR  97           HE2      TYR  97  -7.286   9.827   1.598
  780    HH   TYR  97           HH       TYR  97  -5.476   8.469   4.238
  781    H    LEU  98           H        LEU  98  -7.075   4.282  -1.754
  782    HA   LEU  98           HA       LEU  98  -4.674   5.623  -1.164
  783    HB2  LEU  98           HB3      LEU  98  -5.444   3.031  -1.830
  784    HB3  LEU  98           HB2      LEU  98  -4.384   3.512  -3.140
  785    HG   LEU  98           HG       LEU  98  -3.606   3.708  -0.235
  786   HD11  LEU  98          HD11      LEU  98  -2.134   1.667  -1.336
  787   HD12  LEU  98          HD12      LEU  98  -3.742   1.406  -2.024
  788   HD13  LEU  98          HD13      LEU  98  -3.517   1.477  -0.259
  789   HD21  LEU  98          HD21      LEU  98  -2.104   3.933  -2.833
  790   HD22  LEU  98          HD22      LEU  98  -1.312   3.714  -1.273
  791   HD23  LEU  98          HD23      LEU  98  -2.285   5.154  -1.573
  792    H    LYS  99           H        LYS  99  -6.521   5.254  -4.125
  793    HA   LYS  99           HA       LYS  99  -4.611   6.109  -5.973
  794    HB2  LYS  99           HB3      LYS  99  -7.565   6.704  -6.148
  795    HB3  LYS  99           HB2      LYS  99  -6.429   6.502  -7.475
  796    HG2  LYS  99           HG3      LYS  99  -7.376   4.361  -5.584
  797    HG3  LYS  99           HG2      LYS  99  -7.828   4.552  -7.279
  798    HD2  LYS  99           HD3      LYS  99  -6.128   2.871  -6.595
  799    HD3  LYS  99           HD2      LYS  99  -5.202   4.446  -7.608
  800    HE2  LYS  99           HE3      LYS  99  -4.008   3.713  -5.885
  801    HE3  LYS  99           HE2      LYS  99  -5.445   3.861  -4.874
  802    HZ1  LYS  99           HZ1      LYS  99  -4.089   1.622  -5.570
  803    HZ2  LYS  99           HZ2      LYS  99  -5.603   1.577  -6.320
  804    HZ3  LYS  99           HZ3      LYS  99  -5.497   1.761  -4.643
  805    H    LYS 100           H        LYS 100  -6.947   7.969  -4.057
  806    HA   LYS 100           HA       LYS 100  -6.106  10.483  -5.159
  807    HB2  LYS 100           HB3      LYS 100  -8.166  10.934  -4.386
  808    HB3  LYS 100           HB2      LYS 100  -8.153   9.528  -3.332
  809    HG2  LYS 100           HG3      LYS 100  -6.828  10.831  -1.691
  810    HG3  LYS 100           HG2      LYS 100  -7.008  12.245  -2.731
  811    HD2  LYS 100           HD3      LYS 100  -9.176  10.711  -1.308
  812    HD3  LYS 100           HD2      LYS 100  -8.685  12.386  -1.044
  813    HE2  LYS 100           HE3      LYS 100  -9.760  11.420  -3.679
  814    HE3  LYS 100           HE2      LYS 100 -10.813  11.998  -2.389
  815    HZ1  LYS 100           HZ1      LYS 100  -9.376  13.501  -4.269
  816    HZ2  LYS 100           HZ2      LYS 100  -8.772  13.869  -2.732
  817    HZ3  LYS 100           HZ3      LYS 100 -10.422  14.055  -3.059
  818    H    ALA 101           H        ALA 101  -5.456   8.606  -2.297
  819    HA   ALA 101           HA       ALA 101  -4.080  10.444  -0.730
  820    HB1  ALA 101           HB1      ALA 101  -3.306   7.555  -0.785
  821    HB2  ALA 101           HB2      ALA 101  -4.891   8.048  -0.189
  822    HB3  ALA 101           HB3      ALA 101  -3.427   8.653   0.590
  823    H    THR 102           H        THR 102  -3.087   8.680  -3.537
  824    HA   THR 102           HA       THR 102  -0.312   9.565  -3.149
  825    HB   THR 102           HB       THR 102  -0.244   7.298  -3.758
  826    HG1  THR 102           HG1      THR 102   0.891   7.452  -5.523
  827   HG21  THR 102          HG21      THR 102  -2.737   7.864  -5.146
  828   HG22  THR 102          HG22      THR 102  -2.151   6.369  -4.419
  829   HG23  THR 102          HG23      THR 102  -1.648   6.814  -6.051
  830    H    ASN 103           H        ASN 103  -3.242  10.055  -4.797
  831    HA   ASN 103           HA       ASN 103  -2.241  12.471  -5.964
  832    HB2  ASN 103           HB3      ASN 103  -3.624  10.776  -7.976
  833    HB3  ASN 103           HB2      ASN 103  -2.385  12.005  -8.204
  834   HD21  ASN 103          HD21      ASN 103  -2.975   8.692  -7.229
  835   HD22  ASN 103          HD22      ASN 103  -1.377   8.115  -7.539
  836    H    GLU 104           H        GLU 104  -3.785  13.909  -5.241
  837    HA   GLU 104           HA       GLU 104  -6.211  14.450  -6.127
  838    HB2  GLU 104           HB3      GLU 104  -6.376  12.070  -4.351
  839    HB3  GLU 104           HB2      GLU 104  -7.662  13.262  -4.251
  840    HG2  GLU 104           HG3      GLU 104  -7.000  12.521  -6.986
  841    HG3  GLU 104           HG2      GLU 104  -7.549  11.162  -6.006
  842    HHA  HEC 201           HHA      HEC 201   5.115  -4.976   0.438
  843    HHB  HEC 201           HHB      HEC 201  -0.262  -2.294   0.302
  844    HHC  HEC 201           HHC      HEC 201  -1.883  -5.949   5.187
  845    HHD  HEC 201           HHD      HEC 201   4.056  -5.680   6.757
  846   HMA1  HEC 201          HMA1      HEC 201   0.859  -1.048  -1.092
  847   HMA2  HEC 201          HMA2      HEC 201   2.438  -0.395  -0.669
  848   HMA3  HEC 201          HMA3      HEC 201   2.269  -1.482  -1.405
  849   HAA1  HEC 201          HAA1      HEC 201   4.931  -3.057  -1.482
  850   HAA2  HEC 201          HAA2      HEC 201   5.527  -2.425   0.062
  851   HBA1  HEC 201          HBA1      HEC 201   4.033  -0.430  -0.229
  852   HBA2  HEC 201          HBA2      HEC 201   3.775  -0.965  -1.822
  853   HMB1  HEC 201          HMB1      HEC 201  -3.430  -1.775   2.015
  854   HMB2  HEC 201          HMB2      HEC 201  -3.525  -3.059   0.790
  855   HMB3  HEC 201          HMB3      HEC 201  -2.256  -1.808   0.677
  856    HAB  HEC 201           HAB      HEC 201  -3.732  -3.109   4.520
  857   HBB1  HEC 201          HBB1      HEC 201  -5.188  -5.070   2.732
  858   HBB2  HEC 201          HBB2      HEC 201  -4.540  -3.578   2.021
  859   HBB3  HEC 201          HBB3      HEC 201  -5.653  -3.490   3.418
  860   HMC1  HEC 201          HMC1      HEC 201  -0.936  -7.380   8.515
  861   HMC2  HEC 201          HMC2      HEC 201  -1.734  -7.554   6.929
  862   HMC3  HEC 201          HMC3      HEC 201  -0.583  -8.140   7.259
  863    HAC  HEC 201           HAC      HEC 201   2.991  -6.684   8.251
  864   HBC1  HEC 201          HBC1      HEC 201   3.264  -9.072   7.694
  865   HBC2  HEC 201          HBC2      HEC 201   1.612  -9.381   8.266
  866   HBC3  HEC 201          HBC3      HEC 201   2.865  -8.831   9.413
  867   HMD1  HEC 201          HMD1      HEC 201   5.976  -6.885   6.345
  868   HMD2  HEC 201          HMD2      HEC 201   7.123  -5.592   5.940
  869   HMD3  HEC 201          HMD3      HEC 201   7.211  -7.161   5.089
  870   HAD1  HEC 201          HAD1      HEC 201   7.909  -6.171   3.108
  871   HAD2  HEC 201          HAD2      HEC 201   7.502  -4.746   2.140
  872   HBD1  HEC 201          HBD1      HEC 201   7.801  -7.409   1.249
  873   HBD2  HEC 201          HBD2      HEC 201   7.261  -6.006   0.309
  Start of MODEL    3
    1    H1   GLY   1          1H        GLY   1 -19.360   3.896  -0.460
    2    H2   GLY   1          2H        GLY   1 -18.748   3.368  -1.944
    3    H3   GLY   1          3H        GLY   1 -18.920   5.022  -1.644
    4    HA2  GLY   1           HA2      GLY   1 -17.291   3.658   0.300
    5    HA3  GLY   1           HA3      GLY   1 -16.635   3.616  -1.330
    6    H    ASP   2           H        ASP   2 -16.581   5.293   1.479
    7    HA   ASP   2           HA       ASP   2 -16.000   7.846   0.127
    8    HB2  ASP   2           HB3      ASP   2 -16.613   7.555   3.063
    9    HB3  ASP   2           HB2      ASP   2 -16.655   9.015   2.078
   10    H    VAL   3           H        VAL   3 -14.233   9.117   1.001
   11    HA   VAL   3           HA       VAL   3 -11.876   7.620   1.328
   12    HB   VAL   3           HB       VAL   3 -12.570  10.505   1.455
   13   HG11  VAL   3          HG11      VAL   3 -11.246  10.582   3.359
   14   HG12  VAL   3          HG12      VAL   3 -10.088  10.898   2.067
   15   HG13  VAL   3          HG13      VAL   3 -10.182   9.293   2.793
   16   HG21  VAL   3          HG21      VAL   3 -11.811  10.224  -0.625
   17   HG22  VAL   3          HG22      VAL   3 -11.086   8.662  -0.236
   18   HG23  VAL   3          HG23      VAL   3 -10.200  10.152   0.090
   19    H    GLU   4           H        GLU   4 -13.918   9.337   3.655
   20    HA   GLU   4           HA       GLU   4 -12.284   9.072   5.907
   21    HB2  GLU   4           HB3      GLU   4 -14.205  10.539   5.931
   22    HB3  GLU   4           HB2      GLU   4 -15.295   9.182   5.682
   23    HG2  GLU   4           HG3      GLU   4 -14.408   8.283   7.894
   24    HG3  GLU   4           HG2      GLU   4 -13.720   9.887   8.132
   25    H    LYS   5           H        LYS   5 -14.819   6.926   4.655
   26    HA   LYS   5           HA       LYS   5 -14.646   5.010   6.718
   27    HB2  LYS   5           HB3      LYS   5 -15.507   4.570   3.853
   28    HB3  LYS   5           HB2      LYS   5 -15.898   3.550   5.229
   29    HG2  LYS   5           HG3      LYS   5 -16.812   6.005   6.032
   30    HG3  LYS   5           HG2      LYS   5 -17.157   6.003   4.300
   31    HD2  LYS   5           HD3      LYS   5 -17.828   3.504   5.685
   32    HD3  LYS   5           HD2      LYS   5 -18.762   4.908   6.208
   33    HE2  LYS   5           HE3      LYS   5 -20.027   4.740   4.395
   34    HE3  LYS   5           HE2      LYS   5 -18.606   4.980   3.381
   35    HZ1  LYS   5           HZ1      LYS   5 -20.129   2.643   3.738
   36    HZ2  LYS   5           HZ2      LYS   5 -18.553   2.346   4.273
   37    HZ3  LYS   5           HZ3      LYS   5 -18.819   2.902   2.698
   38    H    GLY   6           H        GLY   6 -12.966   5.373   3.641
   39    HA2  GLY   6           HA3      GLY   6 -11.695   2.859   3.588
   40    HA3  GLY   6           HA2      GLY   6 -11.131   4.308   2.771
   41    H    LYS   7           H        LYS   7 -10.687   5.954   4.961
   42    HA   LYS   7           HA       LYS   7  -8.095   5.239   5.624
   43    HB2  LYS   7           HB3      LYS   7  -8.507   7.507   5.837
   44    HB3  LYS   7           HB2      LYS   7 -10.025   7.257   6.690
   45    HG2  LYS   7           HG3      LYS   7  -7.871   6.210   8.254
   46    HG3  LYS   7           HG2      LYS   7  -7.510   7.871   7.776
   47    HD2  LYS   7           HD3      LYS   7 -10.188   7.930   8.508
   48    HD3  LYS   7           HD2      LYS   7  -9.434   6.871   9.701
   49    HE2  LYS   7           HE3      LYS   7  -8.931   8.792  10.751
   50    HE3  LYS   7           HE2      LYS   7  -7.621   8.882   9.574
   51    HZ1  LYS   7           HZ1      LYS   7  -8.547  10.901   9.232
   52    HZ2  LYS   7           HZ2      LYS   7 -10.093  10.421   9.722
   53    HZ3  LYS   7           HZ3      LYS   7  -9.536  10.022   8.176
   54    H    LYS   8           H        LYS   8 -10.861   4.953   7.481
   55    HA   LYS   8           HA       LYS   8  -9.913   3.842   9.898
   56    HB2  LYS   8           HB3      LYS   8 -12.052   4.584  10.184
   57    HB3  LYS   8           HB2      LYS   8 -12.543   4.126   8.560
   58    HG2  LYS   8           HG3      LYS   8 -11.941   1.925  10.436
   59    HG3  LYS   8           HG2      LYS   8 -13.398   2.869  10.748
   60    HD2  LYS   8           HD3      LYS   8 -14.302   2.344   8.622
   61    HD3  LYS   8           HD2      LYS   8 -12.762   1.697   8.050
   62    HE2  LYS   8           HE3      LYS   8 -14.014   0.452  10.442
   63    HE3  LYS   8           HE2      LYS   8 -14.725   0.119   8.862
   64    HZ1  LYS   8           HZ1      LYS   8 -11.844  -0.251   9.459
   65    HZ2  LYS   8           HZ2      LYS   8 -12.692  -0.789   8.098
   66    HZ3  LYS   8           HZ3      LYS   8 -12.988  -1.489   9.608
   67    H    ILE   9           H        ILE   9 -11.008   2.399   6.868
   68    HA   ILE   9           HA       ILE   9 -11.038  -0.281   7.702
   69    HB   ILE   9           HB       ILE   9 -10.827   1.074   5.054
   70   HG12  ILE   9          HG13      ILE   9 -12.673  -1.066   6.142
   71   HG13  ILE   9          HG12      ILE   9 -13.010   0.663   6.157
   72   HG21  ILE   9          HG21      ILE   9 -10.566  -1.911   5.314
   73   HG22  ILE   9          HG22      ILE   9  -9.184  -0.840   5.081
   74   HG23  ILE   9          HG23      ILE   9 -10.447  -0.931   3.853
   75   HD11  ILE   9          HD11      ILE   9 -13.169  -1.281   3.963
   76   HD12  ILE   9          HD12      ILE   9 -12.507   0.298   3.539
   77   HD13  ILE   9          HD13      ILE   9 -14.111   0.179   4.265
   78    H    PHE  10           H        PHE  10  -8.477   1.678   6.233
   79    HA   PHE  10           HA       PHE  10  -6.532  -0.368   6.095
   80    HB2  PHE  10           HB3      PHE  10  -5.939   1.403   4.760
   81    HB3  PHE  10           HB2      PHE  10  -6.528   2.602   5.904
   82    HD1  PHE  10           HD1      PHE  10  -3.678   1.343   4.423
   83    HD2  PHE  10           HD2      PHE  10  -5.155   2.552   8.227
   84    HE1  PHE  10           HE1      PHE  10  -1.374   1.736   5.189
   85    HE2  PHE  10           HE2      PHE  10  -2.852   2.948   9.001
   86    HZ   PHE  10           HZ       PHE  10  -0.958   2.540   7.480
   87    H    VAL  11           H        VAL  11  -7.383   1.961   8.579
   88    HA   VAL  11           HA       VAL  11  -5.217   1.797  10.258
   89    HB   VAL  11           HB       VAL  11  -8.137   2.050  10.965
   90   HG11  VAL  11          HG11      VAL  11  -5.693   2.238  12.701
   91   HG12  VAL  11          HG12      VAL  11  -7.151   1.281  12.956
   92   HG13  VAL  11          HG13      VAL  11  -7.208   3.036  13.120
   93   HG21  VAL  11          HG21      VAL  11  -6.251   3.820   9.811
   94   HG22  VAL  11          HG22      VAL  11  -6.589   4.389  11.446
   95   HG23  VAL  11          HG23      VAL  11  -7.911   4.155  10.301
   96    H    GLN  12           H        GLN  12  -8.260  -0.404  10.298
   97    HA   GLN  12           HA       GLN  12  -6.952  -2.118  12.324
   98    HB2  GLN  12           HB3      GLN  12  -9.282  -3.322  11.065
   99    HB3  GLN  12           HB2      GLN  12  -9.032  -2.885  12.749
  100    HG2  GLN  12           HG3      GLN  12  -9.429  -0.448  11.606
  101    HG3  GLN  12           HG2      GLN  12 -10.475  -1.481  10.633
  102   HE21  GLN  12          HE21      GLN  12 -12.241  -0.299  11.539
  103   HE22  GLN  12          HE22      GLN  12 -12.835  -0.690  13.112
  104    H    LYS  13           H        LYS  13  -8.024  -2.192   9.144
  105    HA   LYS  13           HA       LYS  13  -7.496  -4.146   7.637
  106    HB2  LYS  13           HB3      LYS  13  -7.101  -1.410   7.409
  107    HB3  LYS  13           HB2      LYS  13  -5.598  -2.126   6.849
  108    HG2  LYS  13           HG3      LYS  13  -8.262  -2.136   5.631
  109    HG3  LYS  13           HG2      LYS  13  -6.666  -2.230   4.884
  110    HD2  LYS  13           HD3      LYS  13  -6.562  -4.614   5.743
  111    HD3  LYS  13           HD2      LYS  13  -8.279  -4.452   6.117
  112    HE2  LYS  13           HE3      LYS  13  -7.004  -5.003   3.602
  113    HE3  LYS  13           HE2      LYS  13  -8.715  -5.058   4.024
  114    HZ1  LYS  13           HZ1      LYS  13  -8.907  -2.725   3.566
  115    HZ2  LYS  13           HZ2      LYS  13  -8.211  -3.482   2.223
  116    HZ3  LYS  13           HZ3      LYS  13  -7.244  -2.587   3.283
  117    H    CYS  14           H        CYS  14  -4.798  -2.480   9.124
  118    HA   CYS  14           HA       CYS  14  -3.064  -4.449   9.531
  119    HB2  CYS  14           HB3      CYS  14  -1.704  -4.914   7.626
  120    HB3  CYS  14           HB2      CYS  14  -3.198  -5.662   7.728
  121    H    ALA  15           H        ALA  15  -3.649  -1.456   9.711
  122    HA   ALA  15           HA       ALA  15  -1.538  -0.116   8.528
  123    HB1  ALA  15           HB1      ALA  15  -2.783   0.729  11.132
  124    HB2  ALA  15           HB2      ALA  15  -3.611   0.871   9.583
  125    HB3  ALA  15           HB3      ALA  15  -2.108   1.751   9.863
  126    H    GLN  16           H        GLN  16  -1.626  -1.905  11.525
  127    HA   GLN  16           HA       GLN  16   0.596  -0.895  12.839
  128    HB2  GLN  16           HB3      GLN  16   0.320  -3.834  12.895
  129    HB3  GLN  16           HB2      GLN  16   0.382  -2.681  14.223
  130    HG2  GLN  16           HG3      GLN  16  -1.984  -2.030  13.553
  131    HG3  GLN  16           HG2      GLN  16  -1.978  -3.489  12.562
  132   HE21  GLN  16          HE21      GLN  16  -0.813  -2.681  15.820
  133   HE22  GLN  16          HE22      GLN  16  -1.628  -3.977  16.618
  134    H    CYS  17           H        CYS  17   0.397  -3.137  10.144
  135    HA   CYS  17           HA       CYS  17   3.196  -3.774  10.157
  136    HB2  CYS  17           HB3      CYS  17   1.357  -4.139   7.804
  137    HB3  CYS  17           HB2      CYS  17   2.757  -5.103   8.264
  138    H    HIS  18           H        HIS  18   1.254  -1.237   8.916
  139    HA   HIS  18           HA       HIS  18   3.459  -0.334   7.189
  140    HB2  HIS  18           HB3      HIS  18   0.552   0.489   7.094
  141    HB3  HIS  18           HB2      HIS  18   1.813   0.995   5.974
  142    HD1  HIS  18           HD1      HIS  18   1.540  -0.188   3.830
  143    HD2  HIS  18           HD2      HIS  18   0.603  -2.628   7.058
  144    HE1  HIS  18           HE1      HIS  18   0.945  -2.420   2.836
  145    H    THR  19           H        THR  19   2.958   0.002  10.170
  146    HA   THR  19           HA       THR  19   3.121   1.608  11.775
  147    HB   THR  19           HB       THR  19   4.571   3.104   9.585
  148    HG1  THR  19           HG1      THR  19   6.399   2.037  10.353
  149   HG21  THR  19          HG21      THR  19   5.019   3.236  12.551
  150   HG22  THR  19          HG22      THR  19   4.094   4.425  11.633
  151   HG23  THR  19          HG23      THR  19   5.808   4.192  11.299
  152    H    VAL  20           H        VAL  20   2.483   3.747  12.473
  153    HA   VAL  20           HA       VAL  20   0.069   4.600  11.126
  154    HB   VAL  20           HB       VAL  20   1.174   5.943  13.568
  155   HG11  VAL  20          HG11      VAL  20  -0.969   6.586  12.235
  156   HG12  VAL  20          HG12      VAL  20  -1.017   6.541  13.998
  157   HG13  VAL  20          HG13      VAL  20  -1.677   5.199  13.064
  158   HG21  VAL  20          HG21      VAL  20   0.173   4.250  14.982
  159   HG22  VAL  20          HG22      VAL  20   1.382   3.513  13.931
  160   HG23  VAL  20          HG23      VAL  20  -0.335   3.331  13.566
  161    H    GLU  21           H        GLU  21   0.601   7.337  12.445
  162    HA   GLU  21           HA       GLU  21   1.308   8.694  10.073
  163    HB2  GLU  21           HB3      GLU  21   1.666  10.303  12.458
  164    HB3  GLU  21           HB2      GLU  21   0.500  10.478  11.154
  165    HG2  GLU  21           HG3      GLU  21  -0.939   8.814  12.221
  166    HG3  GLU  21           HG2      GLU  21   0.230   8.653  13.531
  167    H    LYS  22           H        LYS  22   3.144   9.829   9.501
  168    HA   LYS  22           HA       LYS  22   5.604   8.699  10.034
  169    HB2  LYS  22           HB3      LYS  22   4.906  10.342   8.172
  170    HB3  LYS  22           HB2      LYS  22   5.321  11.607   9.320
  171    HG2  LYS  22           HG3      LYS  22   7.144   9.515   8.163
  172    HG3  LYS  22           HG2      LYS  22   7.196  11.259   7.902
  173    HD2  LYS  22           HD3      LYS  22   7.723   9.820  10.500
  174    HD3  LYS  22           HD2      LYS  22   8.928  10.591   9.468
  175    HE2  LYS  22           HE3      LYS  22   7.982  12.758   9.883
  176    HE3  LYS  22           HE2      LYS  22   6.624  12.046  10.755
  177    HZ1  LYS  22           HZ1      LYS  22   9.111  12.832  11.766
  178    HZ2  LYS  22           HZ2      LYS  22   8.992  11.154  11.948
  179    HZ3  LYS  22           HZ3      LYS  22   7.805  12.163  12.606
  180    H    GLY  23           H        GLY  23   6.837   8.670  11.766
  181    HA2  GLY  23           HA3      GLY  23   7.978  10.540  13.234
  182    HA3  GLY  23           HA2      GLY  23   6.356  10.596  13.910
  183    H    GLY  24           H        GLY  24   5.911   7.728  13.558
  184    HA2  GLY  24           HA3      GLY  24   7.096   6.867  16.039
  185    HA3  GLY  24           HA2      GLY  24   5.995   5.941  15.029
  186    H    LYS  25           H        LYS  25   6.937   4.061  14.573
  187    HA   LYS  25           HA       LYS  25   9.789   4.069  13.847
  188    HB2  LYS  25           HB3      LYS  25   8.641   1.441  14.327
  189    HB3  LYS  25           HB2      LYS  25  10.063   2.191  15.039
  190    HG2  LYS  25           HG3      LYS  25   8.930   2.943  16.858
  191    HG3  LYS  25           HG2      LYS  25   7.416   3.135  15.973
  192    HD2  LYS  25           HD3      LYS  25   8.644   0.533  16.883
  193    HD3  LYS  25           HD2      LYS  25   7.230   1.323  17.581
  194    HE2  LYS  25           HE3      LYS  25   5.911   0.330  16.100
  195    HE3  LYS  25           HE2      LYS  25   6.831   1.038  14.772
  196    HZ1  LYS  25           HZ1      LYS  25   6.880  -1.644  15.810
  197    HZ2  LYS  25           HZ2      LYS  25   8.423  -0.984  15.596
  198    HZ3  LYS  25           HZ3      LYS  25   7.349  -1.062  14.290
  199    H    HIS  26           H        HIS  26  10.472   2.654  12.115
  200    HA   HIS  26           HA       HIS  26   8.876   2.896   9.809
  201    HB2  HIS  26           HB3      HIS  26  10.791   0.809   9.434
  202    HB3  HIS  26           HB2      HIS  26  10.832   2.458   8.823
  203    HD1  HIS  26           HD1      HIS  26  11.567   0.809  12.185
  204    HD2  HIS  26           HD2      HIS  26  13.086   3.696   9.613
  205    HE1  HIS  26           HE1      HIS  26  13.663   1.656  13.287
  206    HE2  HIS  26           HE2      HIS  26  14.513   3.468  11.758
  207    H    LYS  27           H        LYS  27   7.612   1.468   8.701
  208    HA   LYS  27           HA       LYS  27   6.557  -0.753  10.239
  209    HB2  LYS  27           HB3      LYS  27   4.700  -0.655   8.879
  210    HB3  LYS  27           HB2      LYS  27   5.255   1.010   8.787
  211    HG2  LYS  27           HG3      LYS  27   6.608  -0.266   6.737
  212    HG3  LYS  27           HG2      LYS  27   4.991  -0.970   6.701
  213    HD2  LYS  27           HD3      LYS  27   5.428   1.168   5.332
  214    HD3  LYS  27           HD2      LYS  27   3.970   1.091   6.323
  215    HE2  LYS  27           HE3      LYS  27   4.620   2.818   7.568
  216    HE3  LYS  27           HE2      LYS  27   6.222   2.122   7.817
  217    HZ1  LYS  27           HZ1      LYS  27   7.003   3.090   5.827
  218    HZ2  LYS  27           HZ2      LYS  27   6.163   4.315   6.638
  219    HZ3  LYS  27           HZ3      LYS  27   5.446   3.525   5.325
  220    H    THR  28           H        THR  28   5.959  -2.765   8.868
  221    HA   THR  28           HA       THR  28   8.389  -3.984   8.059
  222    HB   THR  28           HB       THR  28   5.776  -5.199   7.303
  223    HG1  THR  28           HG1      THR  28   6.595  -5.210   9.994
  224   HG21  THR  28          HG21      THR  28   6.730  -7.213   7.896
  225   HG22  THR  28          HG22      THR  28   7.912  -6.457   8.964
  226   HG23  THR  28          HG23      THR  28   8.092  -6.323   7.215
  227    H    GLY  29           H        GLY  29   5.618  -2.671   6.310
  228    HA2  GLY  29           HA3      GLY  29   7.227  -2.809   3.846
  229    HA3  GLY  29           HA2      GLY  29   5.563  -3.371   3.837
  230    HA   PRO  30           HA       PRO  30   6.401   1.437   3.056
  231    HB2  PRO  30           HB3      PRO  30   5.337   0.424   0.446
  232    HB3  PRO  30           HB2      PRO  30   6.449   1.762   0.762
  233    HG2  PRO  30           HG3      PRO  30   7.358  -0.588  -0.104
  234    HG3  PRO  30           HG2      PRO  30   8.260   0.355   1.096
  235    HD2  PRO  30           HD3      PRO  30   6.681  -2.132   1.445
  236    HD3  PRO  30           HD2      PRO  30   8.073  -1.536   2.370
  237    H    ASN  31           H        ASN  31   4.748   2.470   3.965
  238    HA   ASN  31           HA       ASN  31   2.197   1.472   4.362
  239    HB2  ASN  31           HB3      ASN  31   3.481   3.594   5.323
  240    HB3  ASN  31           HB2      ASN  31   2.521   4.424   4.103
  241   HD21  ASN  31          HD21      ASN  31   1.842   5.354   6.308
  242   HD22  ASN  31          HD22      ASN  31   0.441   4.634   7.015
  243    H    LEU  32           H        LEU  32   3.071   4.058   2.059
  244    HA   LEU  32           HA       LEU  32   1.599   2.995  -0.012
  245    HB2  LEU  32           HB3      LEU  32  -0.298   4.504  -0.251
  246    HB3  LEU  32           HB2      LEU  32  -0.334   3.544   1.218
  247    HG   LEU  32           HG       LEU  32  -1.384   5.673   1.781
  248   HD11  LEU  32          HD11      LEU  32   1.280   5.301   2.722
  249   HD12  LEU  32          HD12      LEU  32  -0.147   4.620   3.501
  250   HD13  LEU  32          HD13      LEU  32   0.376   6.362   3.522
  251   HD21  LEU  32          HD21      LEU  32  -0.611   7.635   1.019
  252   HD22  LEU  32          HD22      LEU  32   0.059   6.559  -0.207
  253   HD23  LEU  32          HD23      LEU  32   1.050   7.077   1.163
  254    H    HIS  33           H        HIS  33   3.075   5.705   1.509
  255    HA   HIS  33           HA       HIS  33   3.144   7.631  -0.445
  256    HB2  HIS  33           HB3      HIS  33   4.460   7.180   1.978
  257    HB3  HIS  33           HB2      HIS  33   5.755   7.365   0.796
  258    HD1  HIS  33           HD1      HIS  33   6.385   9.636   1.935
  259    HD2  HIS  33           HD2      HIS  33   2.600   9.535   0.221
  260    HE1  HIS  33           HE1      HIS  33   5.640  12.034   1.807
  261    HE2  HIS  33           HE2      HIS  33   3.314  11.942   0.844
  262    H    GLY  34           H        GLY  34   3.883   7.715  -2.459
  263    HA2  GLY  34           HA3      GLY  34   5.192   7.322  -4.313
  264    HA3  GLY  34           HA2      GLY  34   6.362   6.546  -3.256
  265    H    LEU  35           H        LEU  35   3.181   5.324  -3.043
  266    HA   LEU  35           HA       LEU  35   3.915   2.728  -3.802
  267    HB2  LEU  35           HB3      LEU  35   1.985   3.322  -2.349
  268    HB3  LEU  35           HB2      LEU  35   1.139   3.915  -3.765
  269    HG   LEU  35           HG       LEU  35   1.083   1.685  -4.721
  270   HD11  LEU  35          HD11      LEU  35   2.253  -0.096  -3.980
  271   HD12  LEU  35          HD12      LEU  35   2.122   0.384  -2.287
  272   HD13  LEU  35          HD13      LEU  35   3.313   1.157  -3.333
  273   HD21  LEU  35          HD21      LEU  35   0.094   2.047  -1.920
  274   HD22  LEU  35          HD22      LEU  35  -0.185   0.533  -2.784
  275   HD23  LEU  35          HD23      LEU  35  -0.811   2.050  -3.434
  276    H    PHE  36           H        PHE  36   2.097   5.216  -5.572
  277    HA   PHE  36           HA       PHE  36   2.465   3.638  -8.027
  278    HB2  PHE  36           HB3      PHE  36   0.577   5.938  -7.964
  279    HB3  PHE  36           HB2      PHE  36   0.453   4.406  -8.821
  280    HD1  PHE  36           HD1      PHE  36  -0.579   2.500  -7.812
  281    HD2  PHE  36           HD2      PHE  36  -0.058   6.103  -5.608
  282    HE1  PHE  36           HE1      PHE  36  -2.113   1.660  -6.082
  283    HE2  PHE  36           HE2      PHE  36  -1.590   5.267  -3.873
  284    HZ   PHE  36           HZ       PHE  36  -2.619   3.043  -4.111
  285    H    GLY  37           H        GLY  37   4.191   5.750  -6.545
  286    HA2  GLY  37           HA3      GLY  37   4.704   7.394  -8.947
  287    HA3  GLY  37           HA2      GLY  37   4.826   8.046  -7.320
  288    H    ARG  38           H        ARG  38   6.110   5.818  -6.118
  289    HA   ARG  38           HA       ARG  38   8.805   6.274  -7.107
  290    HB2  ARG  38           HB3      ARG  38   7.750   4.906  -4.630
  291    HB3  ARG  38           HB2      ARG  38   9.459   5.013  -5.030
  292    HG2  ARG  38           HG3      ARG  38   9.116   7.535  -5.105
  293    HG3  ARG  38           HG2      ARG  38   7.568   7.229  -4.317
  294    HD2  ARG  38           HD3      ARG  38   8.558   6.996  -2.341
  295    HD3  ARG  38           HD2      ARG  38   9.653   5.775  -2.985
  296    HE   ARG  38           HE       ARG  38  11.252   7.373  -2.736
  297   HH11  ARG  38          HH11      ARG  38   8.314   8.917  -3.785
  298   HH12  ARG  38          HH12      ARG  38   9.031  10.489  -3.913
  299   HH21  ARG  38          HH21      ARG  38  12.207   9.438  -2.899
  300   HH22  ARG  38          HH22      ARG  38  11.246  10.783  -3.409
  301    H    LYS  39           H        LYS  39  10.326   4.333  -7.078
  302    HA   LYS  39           HA       LYS  39   9.579   2.534  -9.043
  303    HB2  LYS  39           HB3      LYS  39  11.921   3.014  -8.450
  304    HB3  LYS  39           HB2      LYS  39  11.715   2.131  -6.943
  305    HG2  LYS  39           HG3      LYS  39  12.691   1.080  -9.257
  306    HG3  LYS  39           HG2      LYS  39  11.996   0.142  -7.934
  307    HD2  LYS  39           HD3      LYS  39  11.025  -0.512 -10.074
  308    HD3  LYS  39           HD2      LYS  39   9.805   0.222  -9.029
  309    HE2  LYS  39           HE3      LYS  39  10.375   2.405 -10.248
  310    HE3  LYS  39           HE2      LYS  39  11.156   1.376 -11.444
  311    HZ1  LYS  39           HZ1      LYS  39   9.185   0.568 -12.172
  312    HZ2  LYS  39           HZ2      LYS  39   8.623   2.063 -11.612
  313    HZ3  LYS  39           HZ3      LYS  39   8.434   0.677 -10.660
  314    H    THR  40           H        THR  40  10.711   0.938  -6.168
  315    HA   THR  40           HA       THR  40   8.127  -0.039  -5.365
  316    HB   THR  40           HB       THR  40   8.626  -2.307  -5.138
  317    HG1  THR  40           HG1      THR  40  10.104  -3.502  -6.049
  318   HG21  THR  40          HG21      THR  40   8.304  -2.065  -7.889
  319   HG22  THR  40          HG22      THR  40   8.590  -2.902  -6.678
  320   HG23  THR  40          HG23      THR  40   7.199  -2.920  -6.375
  321    H    GLY  41           H        GLY  41   8.066   0.449  -3.569
  322    HA2  GLY  41           HA3      GLY  41   8.567   0.506  -1.330
  323    HA3  GLY  41           HA2      GLY  41   9.234  -1.096  -1.589
  324    H    GLN  42           H        GLN  42  10.429   1.915  -2.996
  325    HA   GLN  42           HA       GLN  42  12.993   1.414  -1.664
  326    HB2  GLN  42           HB3      GLN  42  13.469   3.439  -3.451
  327    HB3  GLN  42           HB2      GLN  42  13.726   1.730  -3.762
  328    HG2  GLN  42           HG3      GLN  42  12.479   2.879  -5.547
  329    HG3  GLN  42           HG2      GLN  42  11.590   1.540  -4.825
  330   HE21  GLN  42          HE21      GLN  42   9.521   2.036  -4.836
  331   HE22  GLN  42          HE22      GLN  42   8.833   3.541  -4.344
  332    H    ALA  43           H        ALA  43  11.061   2.466  -0.014
  333    HA   ALA  43           HA       ALA  43  10.844   5.222   0.165
  334    HB1  ALA  43           HB1      ALA  43  10.966   4.406   2.799
  335    HB2  ALA  43           HB2      ALA  43  10.441   2.959   1.939
  336    HB3  ALA  43           HB3      ALA  43   9.523   4.457   1.789
  337    HA   PRO  44           HA       PRO  44  14.686   6.747   1.707
  338    HB2  PRO  44           HB3      PRO  44  14.057   8.430   3.694
  339    HB3  PRO  44           HB2      PRO  44  13.544   8.734   2.030
  340    HG2  PRO  44           HG3      PRO  44  11.980   7.594   4.313
  341    HG3  PRO  44           HG2      PRO  44  11.482   8.789   3.101
  342    HD2  PRO  44           HD3      PRO  44  10.854   6.117   2.978
  343    HD3  PRO  44           HD2      PRO  44  10.957   7.178   1.560
  344    H    GLY  45           H        GLY  45  13.790   7.329   4.923
  345    HA2  GLY  45           HA3      GLY  45  15.831   5.622   5.946
  346    HA3  GLY  45           HA2      GLY  45  14.691   6.563   6.899
  347    H    PHE  46           H        PHE  46  13.005   4.696   4.728
  348    HA   PHE  46           HA       PHE  46  12.106   2.917   6.814
  349    HB2  PHE  46           HB3      PHE  46  10.484   3.908   5.269
  350    HB3  PHE  46           HB2      PHE  46  11.285   3.120   3.911
  351    HD1  PHE  46           HD1      PHE  46   9.491   2.420   7.081
  352    HD2  PHE  46           HD2      PHE  46  10.658   0.979   3.255
  353    HE1  PHE  46           HE1      PHE  46   8.057   0.447   7.393
  354    HE2  PHE  46           HE2      PHE  46   9.226  -0.997   3.557
  355    HZ   PHE  46           HZ       PHE  46   7.924  -1.267   5.627
  356    H    THR  47           H        THR  47  12.557   0.795   7.047
  357    HA   THR  47           HA       THR  47  14.747  -0.288   5.519
  358    HB   THR  47           HB       THR  47  13.817  -0.646   8.098
  359    HG1  THR  47           HG1      THR  47  15.523  -2.154   8.207
  360   HG21  THR  47          HG21      THR  47  13.504  -3.119   8.246
  361   HG22  THR  47          HG22      THR  47  13.222  -3.121   6.505
  362   HG23  THR  47          HG23      THR  47  12.137  -2.229   7.573
  363    H    TYR  48           H        TYR  48  14.214  -0.841   3.494
  364    HA   TYR  48           HA       TYR  48  11.712  -2.010   2.777
  365    HB2  TYR  48           HB3      TYR  48  13.643  -2.510   0.754
  366    HB3  TYR  48           HB2      TYR  48  12.365  -1.300   0.762
  367    HD1  TYR  48           HD1      TYR  48  15.809  -1.847   2.104
  368    HD2  TYR  48           HD2      TYR  48  12.962   0.932   0.595
  369    HE1  TYR  48           HE1      TYR  48  17.509  -0.071   2.179
  370    HE2  TYR  48           HE2      TYR  48  14.655   2.713   0.665
  371    HH   TYR  48           HH       TYR  48  17.767   2.235   2.163
  372    H    THR  49           H        THR  49  11.450  -4.075   1.728
  373    HA   THR  49           HA       THR  49  12.737  -6.198   3.196
  374    HB   THR  49           HB       THR  49  11.144  -7.659   2.134
  375    HG1  THR  49           HG1      THR  49   9.693  -6.628   0.531
  376   HG21  THR  49          HG21      THR  49   9.224  -5.509   2.271
  377   HG22  THR  49          HG22      THR  49  10.331  -5.492   3.643
  378   HG23  THR  49          HG23      THR  49   9.395  -6.943   3.283
  379    H    ASP  50           H        ASP  50  13.417  -8.202   1.834
  380    HA   ASP  50           HA       ASP  50  15.679  -7.543   0.374
  381    HB2  ASP  50           HB3      ASP  50  15.731  -9.741   1.073
  382    HB3  ASP  50           HB2      ASP  50  14.040 -10.019   0.669
  383    H    ALA  51           H        ALA  51  12.373  -8.062  -0.693
  384    HA   ALA  51           HA       ALA  51  12.938  -8.045  -3.483
  385    HB1  ALA  51           HB1      ALA  51  10.820  -8.695  -3.586
  386    HB2  ALA  51           HB2      ALA  51  10.284  -7.134  -2.964
  387    HB3  ALA  51           HB3      ALA  51  10.674  -8.442  -1.846
  388    H    ASN  52           H        ASN  52  11.825  -5.560  -1.196
  389    HA   ASN  52           HA       ASN  52  11.495  -3.486  -3.054
  390    HB2  ASN  52           HB3      ASN  52  12.222  -3.356  -0.119
  391    HB3  ASN  52           HB2      ASN  52  11.721  -1.971  -1.087
  392   HD21  ASN  52          HD21      ASN  52   9.944  -4.087  -2.515
  393   HD22  ASN  52          HD22      ASN  52   8.543  -4.143  -1.504
  394    H    LYS  53           H        LYS  53  14.302  -4.439  -1.114
  395    HA   LYS  53           HA       LYS  53  16.017  -2.362  -1.870
  396    HB2  LYS  53           HB3      LYS  53  17.850  -4.035  -1.326
  397    HB3  LYS  53           HB2      LYS  53  16.686  -3.721  -0.046
  398    HG2  LYS  53           HG3      LYS  53  15.568  -5.786  -0.454
  399    HG3  LYS  53           HG2      LYS  53  16.511  -6.068  -1.917
  400    HD2  LYS  53           HD3      LYS  53  17.669  -7.385  -0.450
  401    HD3  LYS  53           HD2      LYS  53  18.535  -5.864  -0.232
  402    HE2  LYS  53           HE3      LYS  53  18.031  -5.901   1.927
  403    HE3  LYS  53           HE2      LYS  53  16.319  -5.823   1.517
  404    HZ1  LYS  53           HZ1      LYS  53  17.846  -8.025   2.506
  405    HZ2  LYS  53           HZ2      LYS  53  16.997  -8.435   1.101
  406    HZ3  LYS  53           HZ3      LYS  53  16.168  -7.823   2.443
  407    H    ASN  54           H        ASN  54  15.062  -5.301  -3.477
  408    HA   ASN  54           HA       ASN  54  17.097  -5.195  -5.497
  409    HB2  ASN  54           HB3      ASN  54  14.474  -6.710  -5.447
  410    HB3  ASN  54           HB2      ASN  54  15.785  -6.969  -6.593
  411   HD21  ASN  54          HD21      ASN  54  17.142  -6.168  -3.708
  412   HD22  ASN  54          HD22      ASN  54  17.432  -7.753  -3.079
  413    H    LYS  55           H        LYS  55  14.157  -3.596  -4.927
  414    HA   LYS  55           HA       LYS  55  13.110  -1.927  -6.074
  415    HB2  LYS  55           HB3      LYS  55  15.403  -2.393  -7.968
  416    HB3  LYS  55           HB2      LYS  55  14.122  -1.245  -8.330
  417    HG2  LYS  55           HG3      LYS  55  14.929   0.281  -6.915
  418    HG3  LYS  55           HG2      LYS  55  15.277  -0.919  -5.668
  419    HD2  LYS  55           HD3      LYS  55  16.968  -0.121  -8.022
  420    HD3  LYS  55           HD2      LYS  55  17.371  -0.044  -6.305
  421    HE2  LYS  55           HE3      LYS  55  17.004  -2.632  -6.414
  422    HE3  LYS  55           HE2      LYS  55  17.292  -2.399  -8.139
  423    HZ1  LYS  55           HZ1      LYS  55  19.378  -2.849  -7.246
  424    HZ2  LYS  55           HZ2      LYS  55  19.129  -1.879  -5.883
  425    HZ3  LYS  55           HZ3      LYS  55  19.372  -1.164  -7.395
  426    H    GLY  56           H        GLY  56  11.669  -3.990  -6.091
  427    HA2  GLY  56           HA3      GLY  56  11.250  -5.514  -8.368
  428    HA3  GLY  56           HA2      GLY  56   9.998  -5.097  -7.210
  429    H    ILE  57           H        ILE  57   8.406  -3.745  -7.831
  430    HA   ILE  57           HA       ILE  57   8.869  -1.950 -10.055
  431    HB   ILE  57           HB       ILE  57   7.745  -4.377 -10.620
  432   HG12  ILE  57          HG13      ILE  57   8.602  -3.261 -12.398
  433   HG13  ILE  57          HG12      ILE  57   6.896  -2.932 -12.685
  434   HG21  ILE  57          HG21      ILE  57   5.661  -4.031  -9.605
  435   HG22  ILE  57          HG22      ILE  57   5.399  -3.682 -11.316
  436   HG23  ILE  57          HG23      ILE  57   5.580  -2.360 -10.164
  437   HD11  ILE  57          HD11      ILE  57   7.102  -0.746 -12.167
  438   HD12  ILE  57          HD12      ILE  57   8.764  -1.042 -12.683
  439   HD13  ILE  57          HD13      ILE  57   8.359  -1.037 -10.965
  440    H    THR  58           H        THR  58   6.867  -0.593 -10.508
  441    HA   THR  58           HA       THR  58   5.986   0.499  -8.001
  442    HB   THR  58           HB       THR  58   6.414   1.487 -10.592
  443    HG1  THR  58           HG1      THR  58   5.916   3.471  -9.556
  444   HG21  THR  58          HG21      THR  58   4.060   0.931 -11.113
  445   HG22  THR  58          HG22      THR  58   4.412   2.659 -11.170
  446   HG23  THR  58          HG23      THR  58   3.560   1.978  -9.784
  447    H    TRP  59           H        TRP  59   4.332  -0.275  -6.963
  448    HA   TRP  59           HA       TRP  59   2.393  -2.013  -8.065
  449    HB2  TRP  59           HB3      TRP  59   1.715  -0.585  -5.566
  450    HB3  TRP  59           HB2      TRP  59   1.719  -2.312  -5.914
  451    HD1  TRP  59           HD1      TRP  59   4.146   0.526  -4.945
  452    HE1  TRP  59           HE1      TRP  59   6.209  -0.526  -3.821
  453    HE3  TRP  59           HE3      TRP  59   3.020  -4.415  -5.638
  454    HZ2  TRP  59           HZ2      TRP  59   7.223  -3.107  -3.293
  455    HZ3  TRP  59           HZ3      TRP  59   4.589  -6.111  -4.793
  456    HH2  TRP  59           HH2      TRP  59   6.648  -5.469  -3.644
  457    H    LYS  60           H        LYS  60   0.968  -1.369  -9.526
  458    HA   LYS  60           HA       LYS  60  -0.276   1.275  -9.264
  459    HB2  LYS  60           HB3      LYS  60   0.046   1.391 -11.469
  460    HB3  LYS  60           HB2      LYS  60   0.661  -0.255 -11.493
  461    HG2  LYS  60           HG3      LYS  60  -1.072  -0.607 -12.869
  462    HG3  LYS  60           HG2      LYS  60  -1.989  -0.737 -11.369
  463    HD2  LYS  60           HD3      LYS  60  -3.118   1.159 -11.763
  464    HD3  LYS  60           HD2      LYS  60  -1.669   2.010 -12.308
  465    HE2  LYS  60           HE3      LYS  60  -2.317   0.055 -14.256
  466    HE3  LYS  60           HE2      LYS  60  -3.797   0.930 -13.861
  467    HZ1  LYS  60           HZ1      LYS  60  -1.881   1.766 -15.588
  468    HZ2  LYS  60           HZ2      LYS  60  -1.522   2.650 -14.192
  469    HZ3  LYS  60           HZ3      LYS  60  -3.062   2.751 -14.884
  470    H    GLU  61           H        GLU  61  -2.631   1.296 -10.100
  471    HA   GLU  61           HA       GLU  61  -4.199  -0.200  -8.320
  472    HB2  GLU  61           HB3      GLU  61  -4.604   1.963 -10.004
  473    HB3  GLU  61           HB2      GLU  61  -5.657   0.722 -10.669
  474    HG2  GLU  61           HG3      GLU  61  -5.939   0.748  -7.836
  475    HG3  GLU  61           HG2      GLU  61  -6.105   2.393  -8.447
  476    H    GLU  62           H        GLU  62  -3.991  -0.478 -11.873
  477    HA   GLU  62           HA       GLU  62  -5.560  -2.804 -12.064
  478    HB2  GLU  62           HB3      GLU  62  -5.079  -2.775 -14.312
  479    HB3  GLU  62           HB2      GLU  62  -4.727  -1.106 -13.885
  480    HG2  GLU  62           HG3      GLU  62  -2.337  -1.710 -13.678
  481    HG3  GLU  62           HG2      GLU  62  -2.736  -3.334 -14.240
  482    H    THR  63           H        THR  63  -2.049  -2.376 -11.850
  483    HA   THR  63           HA       THR  63  -1.360  -5.085 -12.185
  484    HB   THR  63           HB       THR  63   0.001  -2.656 -11.730
  485    HG1  THR  63           HG1      THR  63   1.324  -3.714 -12.944
  486   HG21  THR  63          HG21      THR  63   1.507  -2.957 -10.026
  487   HG22  THR  63          HG22      THR  63   1.223  -4.695  -9.936
  488   HG23  THR  63          HG23      THR  63   0.022  -3.570  -9.304
  489    H    LEU  64           H        LEU  64  -2.480  -3.258  -9.458
  490    HA   LEU  64           HA       LEU  64  -1.709  -5.120  -7.443
  491    HB2  LEU  64           HB3      LEU  64  -3.192  -2.614  -7.610
  492    HB3  LEU  64           HB2      LEU  64  -3.880  -3.726  -6.441
  493    HG   LEU  64           HG       LEU  64  -1.042  -2.699  -6.469
  494   HD11  LEU  64          HD11      LEU  64  -2.137  -0.942  -5.554
  495   HD12  LEU  64          HD12      LEU  64  -2.034  -1.947  -4.109
  496   HD13  LEU  64          HD13      LEU  64  -3.520  -1.917  -5.061
  497   HD21  LEU  64          HD21      LEU  64  -0.725  -3.917  -4.414
  498   HD22  LEU  64          HD22      LEU  64  -1.227  -5.037  -5.679
  499   HD23  LEU  64          HD23      LEU  64  -2.388  -4.503  -4.464
  500    H    MET  65           H        MET  65  -4.537  -4.658  -9.465
  501    HA   MET  65           HA       MET  65  -6.322  -6.350  -8.124
  502    HB2  MET  65           HB3      MET  65  -6.075  -5.578 -11.029
  503    HB3  MET  65           HB2      MET  65  -7.377  -6.601 -10.434
  504    HG2  MET  65           HG3      MET  65  -6.799  -3.743  -9.716
  505    HG3  MET  65           HG2      MET  65  -8.208  -4.388 -10.558
  506    HE1  MET  65           HE1      MET  65  -6.712  -3.237  -7.375
  507    HE2  MET  65           HE2      MET  65  -6.246  -4.912  -7.074
  508    HE3  MET  65           HE3      MET  65  -7.481  -4.145  -6.076
  509    H    GLU  66           H        GLU  66  -3.922  -7.014 -10.635
  510    HA   GLU  66           HA       GLU  66  -4.552  -9.819 -10.749
  511    HB2  GLU  66           HB3      GLU  66  -2.328  -9.855 -12.065
  512    HB3  GLU  66           HB2      GLU  66  -3.699  -9.005 -12.765
  513    HG2  GLU  66           HG3      GLU  66  -2.801  -6.884 -12.052
  514    HG3  GLU  66           HG2      GLU  66  -1.472  -7.694 -11.224
  515    H    TYR  67           H        TYR  67  -2.155  -7.782  -9.187
  516    HA   TYR  67           HA       TYR  67  -0.428  -9.793  -8.260
  517    HB2  TYR  67           HB3      TYR  67   0.553  -7.749  -7.977
  518    HB3  TYR  67           HB2      TYR  67  -0.969  -6.956  -7.586
  519    HD1  TYR  67           HD1      TYR  67   1.957  -8.657  -6.260
  520    HD2  TYR  67           HD2      TYR  67  -1.859  -7.046  -5.286
  521    HE1  TYR  67           HE1      TYR  67   2.559  -8.690  -3.876
  522    HE2  TYR  67           HE2      TYR  67  -1.267  -7.073  -2.898
  523    HH   TYR  67           HH       TYR  67   0.568  -7.181  -1.456
  524    H    LEU  68           H        LEU  68  -3.560  -8.797  -7.227
  525    HA   LEU  68           HA       LEU  68  -3.504  -9.626  -4.547
  526    HB2  LEU  68           HB3      LEU  68  -5.694  -9.319  -6.573
  527    HB3  LEU  68           HB2      LEU  68  -6.037  -9.971  -4.983
  528    HG   LEU  68           HG       LEU  68  -4.776  -7.272  -5.458
  529   HD11  LEU  68          HD11      LEU  68  -6.904  -6.288  -5.061
  530   HD12  LEU  68          HD12      LEU  68  -7.628  -7.853  -4.693
  531   HD13  LEU  68          HD13      LEU  68  -7.109  -7.485  -6.338
  532   HD21  LEU  68          HD21      LEU  68  -4.233  -8.214  -3.296
  533   HD22  LEU  68          HD22      LEU  68  -5.935  -8.572  -2.997
  534   HD23  LEU  68          HD23      LEU  68  -5.391  -6.899  -3.103
  535    H    GLU  69           H        GLU  69  -3.380 -11.422  -7.429
  536    HA   GLU  69           HA       GLU  69  -4.696 -13.787  -6.696
  537    HB2  GLU  69           HB3      GLU  69  -3.336 -12.900  -8.915
  538    HB3  GLU  69           HB2      GLU  69  -2.282 -14.172  -8.312
  539    HG2  GLU  69           HG3      GLU  69  -4.126 -15.754  -8.376
  540    HG3  GLU  69           HG2      GLU  69  -5.210 -14.482  -8.935
  541    H    ASN  70           H        ASN  70  -1.173 -13.669  -7.036
  542    HA   ASN  70           HA       ASN  70  -0.964 -15.182  -4.515
  543    HB2  ASN  70           HB3      ASN  70   0.429 -15.508  -7.144
  544    HB3  ASN  70           HB2      ASN  70   1.264 -15.975  -5.665
  545   HD21  ASN  70          HD21      ASN  70  -1.083 -16.819  -7.974
  546   HD22  ASN  70          HD22      ASN  70  -1.598 -18.303  -7.254
  547    HA   PRO  71           HA       PRO  71   1.050 -11.172  -3.547
  548    HB2  PRO  71           HB3      PRO  71   1.056 -12.617  -0.937
  549    HB3  PRO  71           HB2      PRO  71   0.619 -10.941  -1.295
  550    HG2  PRO  71           HG3      PRO  71  -1.263 -12.763  -0.821
  551    HG3  PRO  71           HG2      PRO  71  -1.491 -11.518  -2.065
  552    HD2  PRO  71           HD3      PRO  71  -0.848 -14.412  -2.376
  553    HD3  PRO  71           HD2      PRO  71  -1.836 -13.357  -3.405
  554    H    LYS  72           H        LYS  72   2.007 -14.468  -2.745
  555    HA   LYS  72           HA       LYS  72   4.724 -13.743  -2.133
  556    HB2  LYS  72           HB3      LYS  72   4.732 -15.751  -1.164
  557    HB3  LYS  72           HB2      LYS  72   3.082 -15.994  -1.716
  558    HG2  LYS  72           HG3      LYS  72   4.085 -17.840  -2.599
  559    HG3  LYS  72           HG2      LYS  72   4.272 -16.713  -3.943
  560    HD2  LYS  72           HD3      LYS  72   6.471 -16.401  -2.145
  561    HD3  LYS  72           HD2      LYS  72   6.288 -18.110  -2.543
  562    HE2  LYS  72           HE3      LYS  72   5.939 -16.690  -4.945
  563    HE3  LYS  72           HE2      LYS  72   7.339 -15.976  -4.144
  564    HZ1  LYS  72           HZ1      LYS  72   8.327 -18.163  -3.972
  565    HZ2  LYS  72           HZ2      LYS  72   7.954 -17.826  -5.588
  566    HZ3  LYS  72           HZ3      LYS  72   6.970 -18.873  -4.694
  567    H    LYS  73           H        LYS  73   2.926 -14.605  -4.947
  568    HA   LYS  73           HA       LYS  73   5.087 -15.548  -6.533
  569    HB2  LYS  73           HB3      LYS  73   3.570 -15.670  -8.272
  570    HB3  LYS  73           HB2      LYS  73   2.501 -15.764  -6.880
  571    HG2  LYS  73           HG3      LYS  73   1.366 -14.184  -8.005
  572    HG3  LYS  73           HG2      LYS  73   2.536 -13.106  -7.243
  573    HD2  LYS  73           HD3      LYS  73   2.153 -12.861  -9.766
  574    HD3  LYS  73           HD2      LYS  73   3.820 -12.934  -9.192
  575    HE2  LYS  73           HE3      LYS  73   3.293 -14.335 -11.222
  576    HE3  LYS  73           HE2      LYS  73   4.061 -15.183  -9.880
  577    HZ1  LYS  73           HZ1      LYS  73   1.728 -15.824  -9.202
  578    HZ2  LYS  73           HZ2      LYS  73   2.329 -16.563 -10.600
  579    HZ3  LYS  73           HZ3      LYS  73   1.226 -15.286 -10.725
  580    H    TYR  74           H        TYR  74   3.807 -12.389  -5.788
  581    HA   TYR  74           HA       TYR  74   5.294 -11.062  -7.875
  582    HB2  TYR  74           HB3      TYR  74   3.358 -10.270  -5.784
  583    HB3  TYR  74           HB2      TYR  74   4.540  -9.045  -6.234
  584    HD1  TYR  74           HD1      TYR  74   2.046 -11.382  -7.719
  585    HD2  TYR  74           HD2      TYR  74   4.172  -7.720  -8.114
  586    HE1  TYR  74           HE1      TYR  74   0.695 -10.817  -9.695
  587    HE2  TYR  74           HE2      TYR  74   2.829  -7.144 -10.090
  588    HH   TYR  74           HH       TYR  74   0.594  -9.432 -11.523
  589    H    ILE  75           H        ILE  75   5.527 -11.400  -4.352
  590    HA   ILE  75           HA       ILE  75   8.350 -10.602  -4.551
  591    HB   ILE  75           HB       ILE  75   6.337  -9.621  -2.539
  592   HG12  ILE  75          HG13      ILE  75   6.390  -8.115  -4.319
  593   HG13  ILE  75          HG12      ILE  75   7.567  -7.427  -3.205
  594   HG21  ILE  75          HG21      ILE  75   8.352  -8.539  -1.438
  595   HG22  ILE  75          HG22      ILE  75   9.336  -9.682  -2.355
  596   HG23  ILE  75          HG23      ILE  75   8.154 -10.274  -1.188
  597   HD11  ILE  75          HD11      ILE  75   8.875  -7.331  -5.010
  598   HD12  ILE  75          HD12      ILE  75   7.931  -8.539  -5.884
  599   HD13  ILE  75          HD13      ILE  75   9.141  -9.047  -4.705
  600    HA   PRO  76           HA       PRO  76   7.882 -14.780  -2.554
  601    HB2  PRO  76           HB3      PRO  76  10.586 -14.984  -3.759
  602    HB3  PRO  76           HB2      PRO  76   9.241 -16.129  -3.811
  603    HG2  PRO  76           HG3      PRO  76   9.890 -14.682  -5.955
  604    HG3  PRO  76           HG2      PRO  76   8.197 -15.028  -5.563
  605    HD2  PRO  76           HD3      PRO  76   9.762 -12.513  -5.158
  606    HD3  PRO  76           HD2      PRO  76   8.072 -12.721  -5.663
  607    H    GLY  77           H        GLY  77   8.536 -15.179  -0.527
  608    HA2  GLY  77           HA3      GLY  77  10.289 -15.370   1.118
  609    HA3  GLY  77           HA2      GLY  77  11.049 -13.956   0.405
  610    H    THR  78           H        THR  78   8.172 -12.806   0.281
  611    HA   THR  78           HA       THR  78   8.267 -11.712   2.999
  612    HB   THR  78           HB       THR  78   8.070 -10.455   0.563
  613    HG1  THR  78           HG1      THR  78   7.094  -9.428   3.014
  614   HG21  THR  78          HG21      THR  78   5.639 -11.261   0.533
  615   HG22  THR  78          HG22      THR  78   5.964  -9.556   0.221
  616   HG23  THR  78          HG23      THR  78   5.381 -10.066   1.807
  617    H    LYS  79           H        LYS  79   6.757 -12.176   4.454
  618    HA   LYS  79           HA       LYS  79   4.356 -13.615   3.552
  619    HB2  LYS  79           HB3      LYS  79   6.086 -14.604   5.245
  620    HB3  LYS  79           HB2      LYS  79   5.277 -13.555   6.403
  621    HG2  LYS  79           HG3      LYS  79   4.511 -16.015   6.136
  622    HG3  LYS  79           HG2      LYS  79   3.306 -14.736   6.307
  623    HD2  LYS  79           HD3      LYS  79   2.780 -16.378   4.513
  624    HD3  LYS  79           HD2      LYS  79   2.910 -14.713   3.938
  625    HE2  LYS  79           HE3      LYS  79   4.023 -16.369   2.460
  626    HE3  LYS  79           HE2      LYS  79   5.108 -15.121   3.074
  627    HZ1  LYS  79           HZ1      LYS  79   6.030 -17.406   3.147
  628    HZ2  LYS  79           HZ2      LYS  79   4.844 -17.821   4.279
  629    HZ3  LYS  79           HZ3      LYS  79   5.996 -16.642   4.657
  630    H    MET  80           H        MET  80   2.335 -12.927   4.121
  631    HA   MET  80           HA       MET  80   2.194 -10.272   5.375
  632    HB2  MET  80           HB3      MET  80   0.514 -11.688   3.345
  633    HB3  MET  80           HB2      MET  80  -0.227 -10.453   4.352
  634    HG2  MET  80           HG3      MET  80   2.286  -9.916   2.819
  635    HG3  MET  80           HG2      MET  80   0.696  -9.767   2.072
  636    HE1  MET  80           HE1      MET  80  -0.602  -8.173   2.008
  637    HE2  MET  80           HE2      MET  80  -0.055  -6.518   2.283
  638    HE3  MET  80           HE3      MET  80  -1.158  -7.286   3.426
  639    H    ILE  81           H        ILE  81   1.730 -10.343   7.066
  640    HA   ILE  81           HA       ILE  81  -0.088 -12.434   8.453
  641    HB   ILE  81           HB       ILE  81   1.816 -10.724  10.055
  642   HG12  ILE  81          HG13      ILE  81   2.994 -13.016  10.293
  643   HG13  ILE  81          HG12      ILE  81   2.082 -13.471   8.857
  644   HG21  ILE  81          HG21      ILE  81  -0.001 -11.437  11.419
  645   HG22  ILE  81          HG22      ILE  81   1.381 -12.462  11.804
  646   HG23  ILE  81          HG23      ILE  81   0.083 -13.077  10.777
  647   HD11  ILE  81          HD11      ILE  81   3.242 -11.011   8.242
  648   HD12  ILE  81          HD12      ILE  81   3.716 -12.601   7.649
  649   HD13  ILE  81          HD13      ILE  81   4.491 -11.929   9.082
  650    H    PHE  82           H        PHE  82  -2.027 -11.903   9.247
  651    HA   PHE  82           HA       PHE  82  -3.530 -10.580  10.487
  652    HB2  PHE  82           HB3      PHE  82  -1.432  -8.964  10.755
  653    HB3  PHE  82           HB2      PHE  82  -2.304  -8.033   9.544
  654    HD1  PHE  82           HD1      PHE  82  -3.890  -6.512  10.234
  655    HD2  PHE  82           HD2      PHE  82  -2.844  -9.727  12.816
  656    HE1  PHE  82           HE1      PHE  82  -5.310  -5.552  11.995
  657    HE2  PHE  82           HE2      PHE  82  -4.265  -8.774  14.585
  658    HZ   PHE  82           HZ       PHE  82  -5.501  -6.683  14.175
  659    H    ALA  83           H        ALA  83  -5.137  -8.783   9.774
  660    HA   ALA  83           HA       ALA  83  -5.742  -7.646   7.541
  661    HB1  ALA  83           HB1      ALA  83  -6.698  -9.608   6.056
  662    HB2  ALA  83           HB2      ALA  83  -5.435 -10.525   6.875
  663    HB3  ALA  83           HB3      ALA  83  -5.016  -9.094   5.934
  664    H    GLY  84           H        GLY  84  -7.247  -6.945   9.126
  665    HA2  GLY  84           HA3      GLY  84  -9.365  -8.686  10.000
  666    HA3  GLY  84           HA2      GLY  84  -9.237  -6.962  10.304
  667    H    ILE  85           H        ILE  85  -9.120  -8.388   7.105
  668    HA   ILE  85           HA       ILE  85 -11.837  -7.392   6.580
  669    HB   ILE  85           HB       ILE  85  -9.421  -6.942   4.826
  670   HG12  ILE  85          HG13      ILE  85  -9.617  -5.392   6.738
  671   HG13  ILE  85          HG12      ILE  85  -9.871  -4.568   5.202
  672   HG21  ILE  85          HG21      ILE  85 -11.887  -7.466   3.888
  673   HG22  ILE  85          HG22      ILE  85 -10.748  -6.381   3.090
  674   HG23  ILE  85          HG23      ILE  85 -12.013  -5.723   4.131
  675   HD11  ILE  85          HD11      ILE  85 -12.274  -4.620   5.564
  676   HD12  ILE  85          HD12      ILE  85 -11.442  -3.816   6.894
  677   HD13  ILE  85          HD13      ILE  85 -12.031  -5.467   7.093
  678    H    LYS  86           H        LYS  86 -13.093  -8.876   5.680
  679    HA   LYS  86           HA       LYS  86 -11.830 -11.051   4.150
  680    HB2  LYS  86           HB3      LYS  86 -13.785 -12.465   4.980
  681    HB3  LYS  86           HB2      LYS  86 -12.534 -12.079   6.153
  682    HG2  LYS  86           HG3      LYS  86 -13.889 -10.477   7.224
  683    HG3  LYS  86           HG2      LYS  86 -15.053 -10.466   5.898
  684    HD2  LYS  86           HD3      LYS  86 -15.375 -12.967   6.468
  685    HD3  LYS  86           HD2      LYS  86 -14.598 -12.557   7.999
  686    HE2  LYS  86           HE3      LYS  86 -16.500 -11.715   8.777
  687    HE3  LYS  86           HE2      LYS  86 -16.602 -10.609   7.410
  688    HZ1  LYS  86           HZ1      LYS  86 -18.533 -11.854   7.260
  689    HZ2  LYS  86           HZ2      LYS  86 -17.773 -13.302   7.691
  690    HZ3  LYS  86           HZ3      LYS  86 -17.508 -12.634   6.160
  691    H    LYS  87           H        LYS  87 -12.575  -8.854   2.807
  692    HA   LYS  87           HA       LYS  87 -14.637  -9.877   1.082
  693    HB2  LYS  87           HB3      LYS  87 -15.110  -7.540   2.876
  694    HB3  LYS  87           HB2      LYS  87 -15.773  -7.495   1.248
  695    HG2  LYS  87           HG3      LYS  87 -17.106  -9.407   1.633
  696    HG3  LYS  87           HG2      LYS  87 -16.261  -9.776   3.138
  697    HD2  LYS  87           HD3      LYS  87 -17.307  -8.063   4.295
  698    HD3  LYS  87           HD2      LYS  87 -17.686  -7.165   2.824
  699    HE2  LYS  87           HE3      LYS  87 -19.227  -9.107   2.235
  700    HE3  LYS  87           HE2      LYS  87 -19.019  -9.634   3.903
  701    HZ1  LYS  87           HZ1      LYS  87 -19.864  -7.473   4.629
  702    HZ2  LYS  87           HZ2      LYS  87 -20.998  -8.299   3.684
  703    HZ3  LYS  87           HZ3      LYS  87 -20.113  -7.019   3.019
  704    H    LYS  88           H        LYS  88 -13.805  -9.611  -0.873
  705    HA   LYS  88           HA       LYS  88 -11.608  -8.107  -1.555
  706    HB2  LYS  88           HB3      LYS  88 -11.913  -9.066  -3.552
  707    HB3  LYS  88           HB2      LYS  88 -13.375  -9.785  -2.892
  708    HG2  LYS  88           HG3      LYS  88 -13.443  -7.044  -4.084
  709    HG3  LYS  88           HG2      LYS  88 -13.497  -8.476  -5.112
  710    HD2  LYS  88           HD3      LYS  88 -15.368  -9.169  -3.339
  711    HD3  LYS  88           HD2      LYS  88 -15.512  -7.415  -3.214
  712    HE2  LYS  88           HE3      LYS  88 -15.912  -7.235  -5.585
  713    HE3  LYS  88           HE2      LYS  88 -15.618  -8.960  -5.801
  714    HZ1  LYS  88           HZ1      LYS  88 -18.039  -7.801  -5.394
  715    HZ2  LYS  88           HZ2      LYS  88 -17.658  -8.412  -3.864
  716    HZ3  LYS  88           HZ3      LYS  88 -17.691  -9.445  -5.202
  717    H    THR  89           H        THR  89 -14.998  -7.149  -1.569
  718    HA   THR  89           HA       THR  89 -14.687  -4.685  -2.890
  719    HB   THR  89           HB       THR  89 -16.844  -5.991  -2.295
  720    HG1  THR  89           HG1      THR  89 -17.201  -4.156  -3.353
  721   HG21  THR  89          HG21      THR  89 -17.192  -4.136  -0.036
  722   HG22  THR  89          HG22      THR  89 -16.202  -5.564   0.266
  723   HG23  THR  89          HG23      THR  89 -17.861  -5.745  -0.307
  724    H    GLU  90           H        GLU  90 -13.982  -5.685   0.339
  725    HA   GLU  90           HA       GLU  90 -13.976  -3.073   1.511
  726    HB2  GLU  90           HB3      GLU  90 -12.655  -5.628   2.452
  727    HB3  GLU  90           HB2      GLU  90 -12.863  -4.169   3.414
  728    HG2  GLU  90           HG3      GLU  90 -15.231  -5.547   2.220
  729    HG3  GLU  90           HG2      GLU  90 -14.506  -6.132   3.718
  730    H    ARG  91           H        ARG  91 -11.492  -5.294   0.328
  731    HA   ARG  91           HA       ARG  91  -9.284  -3.611   0.856
  732    HB2  ARG  91           HB3      ARG  91  -9.724  -6.012  -1.037
  733    HB3  ARG  91           HB2      ARG  91  -8.167  -5.081  -0.871
  734    HG2  ARG  91           HG3      ARG  91  -8.606  -5.688   1.723
  735    HG3  ARG  91           HG2      ARG  91  -9.398  -7.060   0.922
  736    HD2  ARG  91           HD3      ARG  91  -6.760  -6.866  -0.368
  737    HD3  ARG  91           HD2      ARG  91  -6.652  -6.587   1.368
  738    HE   ARG  91           HE       ARG  91  -7.977  -8.709   1.416
  739   HH11  ARG  91          HH11      ARG  91  -5.588  -7.771  -0.941
  740   HH12  ARG  91          HH12      ARG  91  -5.047  -9.323  -1.207
  741   HH21  ARG  91          HH21      ARG  91  -7.288 -10.850   1.026
  742   HH22  ARG  91          HH22      ARG  91  -6.028 -11.153  -0.108
  743    H    GLU  92           H        GLU  92 -11.212  -4.181  -2.066
  744    HA   GLU  92           HA       GLU  92  -9.760  -2.583  -3.826
  745    HB2  GLU  92           HB3      GLU  92 -12.760  -2.922  -3.850
  746    HB3  GLU  92           HB2      GLU  92 -11.718  -2.554  -5.219
  747    HG2  GLU  92           HG3      GLU  92 -12.442  -5.107  -4.072
  748    HG3  GLU  92           HG2      GLU  92 -11.742  -4.730  -5.645
  749    H    ASP  93           H        ASP  93 -12.265  -1.722  -1.503
  750    HA   ASP  93           HA       ASP  93 -12.736   0.907  -2.327
  751    HB2  ASP  93           HB3      ASP  93 -13.683  -0.701  -0.318
  752    HB3  ASP  93           HB2      ASP  93 -12.763   0.498   0.584
  753    H    GLY  94           H        GLY  94 -10.383  -0.369   0.014
  754    HA2  GLY  94           HA3      GLY  94  -9.278   2.067   0.820
  755    HA3  GLY  94           HA2      GLY  94  -8.434   0.525   0.833
  756    H    ILE  95           H        ILE  95  -8.649   0.115  -2.026
  757    HA   ILE  95           HA       ILE  95  -6.263   1.302  -2.866
  758    HB   ILE  95           HB       ILE  95  -8.441   0.276  -4.684
  759   HG12  ILE  95          HG13      ILE  95  -6.816  -1.106  -2.718
  760   HG13  ILE  95          HG12      ILE  95  -8.164  -1.710  -3.677
  761   HG21  ILE  95          HG21      ILE  95  -6.856   0.103  -6.338
  762   HG22  ILE  95          HG22      ILE  95  -5.516   0.028  -5.195
  763   HG23  ILE  95          HG23      ILE  95  -6.323   1.565  -5.505
  764   HD11  ILE  95          HD11      ILE  95  -6.363  -3.066  -4.256
  765   HD12  ILE  95          HD12      ILE  95  -5.247  -1.703  -4.344
  766   HD13  ILE  95          HD13      ILE  95  -6.485  -1.911  -5.583
  767    H    ALA  96           H        ALA  96  -9.634   2.165  -3.584
  768    HA   ALA  96           HA       ALA  96  -9.152   4.237  -5.383
  769    HB1  ALA  96           HB1      ALA  96 -11.395   4.178  -3.371
  770    HB2  ALA  96           HB2      ALA  96 -11.375   3.213  -4.845
  771    HB3  ALA  96           HB3      ALA  96 -11.378   4.973  -4.946
  772    H    TYR  97           H        TYR  97  -9.302   4.262  -1.852
  773    HA   TYR  97           HA       TYR  97  -9.019   7.060  -1.538
  774    HB2  TYR  97           HB3      TYR  97  -9.856   5.810   0.315
  775    HB3  TYR  97           HB2      TYR  97  -8.458   4.741   0.311
  776    HD1  TYR  97           HD1      TYR  97  -9.923   7.516   1.870
  777    HD2  TYR  97           HD2      TYR  97  -6.142   5.974   0.682
  778    HE1  TYR  97           HE1      TYR  97  -8.820   8.963   3.525
  779    HE2  TYR  97           HE2      TYR  97  -5.028   7.416   2.332
  780    HH   TYR  97           HH       TYR  97  -6.797   9.840   4.146
  781    H    LEU  98           H        LEU  98  -6.725   4.406  -1.780
  782    HA   LEU  98           HA       LEU  98  -4.402   5.843  -1.088
  783    HB2  LEU  98           HB3      LEU  98  -5.054   3.223  -1.902
  784    HB3  LEU  98           HB2      LEU  98  -3.850   3.803  -3.036
  785    HG   LEU  98           HG       LEU  98  -3.261   4.252  -0.170
  786   HD11  LEU  98          HD11      LEU  98  -2.265   1.807  -0.306
  787   HD12  LEU  98          HD12      LEU  98  -3.648   1.562  -1.373
  788   HD13  LEU  98          HD13      LEU  98  -3.898   2.111   0.284
  789   HD21  LEU  98          HD21      LEU  98  -1.503   4.916  -1.465
  790   HD22  LEU  98          HD22      LEU  98  -1.815   3.705  -2.710
  791   HD23  LEU  98          HD23      LEU  98  -1.046   3.233  -1.194
  792    H    LYS  99           H        LYS  99  -6.083   5.353  -4.145
  793    HA   LYS  99           HA       LYS  99  -4.148   6.370  -5.880
  794    HB2  LYS  99           HB3      LYS  99  -6.969   7.001  -6.508
  795    HB3  LYS  99           HB2      LYS  99  -5.746   6.212  -7.492
  796    HG2  LYS  99           HG3      LYS  99  -6.066   4.235  -5.836
  797    HG3  LYS  99           HG2      LYS  99  -7.597   5.036  -5.470
  798    HD2  LYS  99           HD3      LYS  99  -6.964   4.722  -8.333
  799    HD3  LYS  99           HD2      LYS  99  -7.274   3.226  -7.450
  800    HE2  LYS  99           HE3      LYS  99  -9.456   3.759  -7.039
  801    HE3  LYS  99           HE2      LYS  99  -9.144   5.493  -7.034
  802    HZ1  LYS  99           HZ1      LYS  99  -8.849   5.346  -9.470
  803    HZ2  LYS  99           HZ2      LYS  99 -10.411   4.945  -8.963
  804    HZ3  LYS  99           HZ3      LYS  99  -9.328   3.725  -9.411
  805    H    LYS 100           H        LYS 100  -6.733   8.024  -4.103
  806    HA   LYS 100           HA       LYS 100  -6.115  10.599  -5.171
  807    HB2  LYS 100           HB3      LYS 100  -7.790   9.677  -2.843
  808    HB3  LYS 100           HB2      LYS 100  -7.593  11.377  -3.244
  809    HG2  LYS 100           HG3      LYS 100  -9.195  11.237  -4.758
  810    HG3  LYS 100           HG2      LYS 100  -8.327   9.951  -5.602
  811    HD2  LYS 100           HD3      LYS 100  -9.842   8.472  -4.933
  812    HD3  LYS 100           HD2      LYS 100  -9.488   8.854  -3.245
  813    HE2  LYS 100           HE3      LYS 100 -11.301  10.584  -4.897
  814    HE3  LYS 100           HE2      LYS 100 -11.903   9.142  -4.080
  815    HZ1  LYS 100           HZ1      LYS 100 -11.791  11.571  -2.963
  816    HZ2  LYS 100           HZ2      LYS 100 -10.328  10.914  -2.422
  817    HZ3  LYS 100           HZ3      LYS 100 -11.784  10.125  -2.086
  818    H    ALA 101           H        ALA 101  -5.281   8.791  -2.310
  819    HA   ALA 101           HA       ALA 101  -4.115  10.739  -0.721
  820    HB1  ALA 101           HB1      ALA 101  -4.577   8.130  -0.396
  821    HB2  ALA 101           HB2      ALA 101  -3.452   9.035   0.617
  822    HB3  ALA 101           HB3      ALA 101  -2.846   8.070  -0.728
  823    H    THR 102           H        THR 102  -2.929   9.188  -3.573
  824    HA   THR 102           HA       THR 102  -0.281  10.393  -3.154
  825    HB   THR 102           HB       THR 102   0.591   8.691  -4.364
  826    HG1  THR 102           HG1      THR 102  -0.491   7.974  -6.338
  827   HG21  THR 102          HG21      THR 102  -1.752   7.079  -4.816
  828   HG22  THR 102          HG22      THR 102  -1.705   7.702  -3.167
  829   HG23  THR 102          HG23      THR 102  -0.348   6.771  -3.797
  830    H    ASN 103           H        ASN 103  -3.246  10.571  -4.799
  831    HA   ASN 103           HA       ASN 103  -2.531  13.117  -5.907
  832    HB2  ASN 103           HB3      ASN 103  -2.656  12.690  -8.162
  833    HB3  ASN 103           HB2      ASN 103  -1.961  11.165  -7.618
  834   HD21  ASN 103          HD21      ASN 103  -3.286   9.331  -7.487
  835   HD22  ASN 103          HD22      ASN 103  -4.773   9.230  -8.363
  836    H    GLU 104           H        GLU 104  -4.153  14.235  -5.112
  837    HA   GLU 104           HA       GLU 104  -6.607  14.579  -5.959
  838    HB2  GLU 104           HB3      GLU 104  -6.549  12.050  -4.394
  839    HB3  GLU 104           HB2      GLU 104  -7.958  13.085  -4.235
  840    HG2  GLU 104           HG3      GLU 104  -7.354  11.223  -6.277
  841    HG3  GLU 104           HG2      GLU 104  -8.782  12.242  -6.102
  842    HHA  HEC 201           HHA      HEC 201   5.059  -5.125   0.487
  843    HHB  HEC 201           HHB      HEC 201  -0.530  -2.439   0.319
  844    HHC  HEC 201           HHC      HEC 201  -2.145  -6.087   5.210
  845    HHD  HEC 201           HHD      HEC 201   3.983  -5.812   6.803
  846   HMA1  HEC 201          HMA1      HEC 201   0.807  -1.143  -1.253
  847   HMA2  HEC 201          HMA2      HEC 201   2.409  -0.302  -0.742
  848   HMA3  HEC 201          HMA3      HEC 201   2.221  -1.572  -1.561
  849   HAA1  HEC 201          HAA1      HEC 201   4.894  -3.002  -1.424
  850   HAA2  HEC 201          HAA2      HEC 201   5.482  -2.360   0.119
  851   HBA1  HEC 201          HBA1      HEC 201   4.004  -0.323  -0.295
  852   HBA2  HEC 201          HBA2      HEC 201   3.738  -0.959  -1.932
  853   HMB1  HEC 201          HMB1      HEC 201  -3.707  -1.934   2.017
  854   HMB2  HEC 201          HMB2      HEC 201  -3.789  -3.218   0.796
  855   HMB3  HEC 201          HMB3      HEC 201  -2.526  -1.964   0.684
  856    HAB  HEC 201           HAB      HEC 201  -4.008  -3.260   4.514
  857   HBB1  HEC 201          HBB1      HEC 201  -5.444  -5.236   2.741
  858   HBB2  HEC 201          HBB2      HEC 201  -4.803  -3.742   2.028
  859   HBB3  HEC 201          HBB3      HEC 201  -5.921  -3.659   3.418
  860   HMC1  HEC 201          HMC1      HEC 201  -1.002  -7.539   8.553
  861   HMC2  HEC 201          HMC2      HEC 201  -1.993  -7.683   6.959
  862   HMC3  HEC 201          HMC3      HEC 201  -0.644  -8.300   7.299
  863    HAC  HEC 201           HAC      HEC 201   2.924  -6.822   8.295
  864   HBC1  HEC 201          HBC1      HEC 201   3.197  -9.210   7.738
  865   HBC2  HEC 201          HBC2      HEC 201   1.545  -9.519   8.310
  866   HBC3  HEC 201          HBC3      HEC 201   2.798  -8.969   9.457
  867   HMD1  HEC 201          HMD1      HEC 201   5.911  -7.007   6.403
  868   HMD2  HEC 201          HMD2      HEC 201   7.053  -5.709   5.997
  869   HMD3  HEC 201          HMD3      HEC 201   7.153  -7.277   5.152
  870   HAD1  HEC 201          HAD1      HEC 201   7.850  -6.293   3.171
  871   HAD2  HEC 201          HAD2      HEC 201   7.442  -4.872   2.196
  872   HBD1  HEC 201          HBD1      HEC 201   7.759  -7.538   1.317
  873   HBD2  HEC 201          HBD2      HEC 201   7.215  -6.140   0.370
  Start of MODEL    4
    1    H1   GLY   1          1H        GLY   1 -19.470   3.962  -0.277
    2    H2   GLY   1          2H        GLY   1 -18.874   3.419  -1.764
    3    H3   GLY   1          3H        GLY   1 -19.033   5.077  -1.472
    4    HA2  GLY   1           HA2      GLY   1 -17.395   3.716   0.465
    5    HA3  GLY   1           HA3      GLY   1 -16.755   3.658  -1.170
    6    H    ASP   2           H        ASP   2 -16.664   5.354   1.627
    7    HA   ASP   2           HA       ASP   2 -16.078   7.894   0.251
    8    HB2  ASP   2           HB3      ASP   2 -16.667   7.627   3.195
    9    HB3  ASP   2           HB2      ASP   2 -16.708   9.080   2.201
   10    H    VAL   3           H        VAL   3 -14.295   9.159   1.101
   11    HA   VAL   3           HA       VAL   3 -11.944   7.649   1.418
   12    HB   VAL   3           HB       VAL   3 -12.620  10.538   1.530
   13   HG11  VAL   3          HG11      VAL   3 -11.277  10.620   3.420
   14   HG12  VAL   3          HG12      VAL   3 -10.129  10.920   2.116
   15   HG13  VAL   3          HG13      VAL   3 -10.227   9.321   2.854
   16   HG21  VAL   3          HG21      VAL   3 -11.881  10.238  -0.555
   17   HG22  VAL   3          HG22      VAL   3 -11.164   8.675  -0.162
   18   HG23  VAL   3          HG23      VAL   3 -10.264  10.161   0.145
   19    H    GLU   4           H        GLU   4 -13.954   9.394   3.750
   20    HA   GLU   4           HA       GLU   4 -12.301   9.135   5.987
   21    HB2  GLU   4           HB3      GLU   4 -14.212  10.614   6.020
   22    HB3  GLU   4           HB2      GLU   4 -15.313   9.263   5.791
   23    HG2  GLU   4           HG3      GLU   4 -14.413   8.373   8.000
   24    HG3  GLU   4           HG2      GLU   4 -13.711   9.975   8.221
   25    H    LYS   5           H        LYS   5 -14.861   6.997   4.774
   26    HA   LYS   5           HA       LYS   5 -14.682   5.094   6.849
   27    HB2  LYS   5           HB3      LYS   5 -15.572   4.640   3.995
   28    HB3  LYS   5           HB2      LYS   5 -15.957   3.631   5.382
   29    HG2  LYS   5           HG3      LYS   5 -16.847   6.099   6.176
   30    HG3  LYS   5           HG2      LYS   5 -17.209   6.086   4.448
   31    HD2  LYS   5           HD3      LYS   5 -17.883   3.602   5.855
   32    HD3  LYS   5           HD2      LYS   5 -18.803   5.015   6.379
   33    HE2  LYS   5           HE3      LYS   5 -20.087   4.843   4.578
   34    HE3  LYS   5           HE2      LYS   5 -18.673   5.067   3.549
   35    HZ1  LYS   5           HZ1      LYS   5 -20.208   2.743   3.936
   36    HZ2  LYS   5           HZ2      LYS   5 -18.628   2.439   4.458
   37    HZ3  LYS   5           HZ3      LYS   5 -18.905   2.985   2.883
   38    H    GLY   6           H        GLY   6 -13.029   5.424   3.755
   39    HA2  GLY   6           HA3      GLY   6 -11.775   2.901   3.708
   40    HA3  GLY   6           HA2      GLY   6 -11.207   4.341   2.876
   41    H    LYS   7           H        LYS   7 -10.733   6.000   5.050
   42    HA   LYS   7           HA       LYS   7  -8.141   5.272   5.694
   43    HB2  LYS   7           HB3      LYS   7  -8.535   7.544   5.895
   44    HB3  LYS   7           HB2      LYS   7 -10.047   7.311   6.763
   45    HG2  LYS   7           HG3      LYS   7  -7.885   6.261   8.314
   46    HG3  LYS   7           HG2      LYS   7  -7.518   7.915   7.822
   47    HD2  LYS   7           HD3      LYS   7 -10.189   7.998   8.578
   48    HD3  LYS   7           HD2      LYS   7  -9.431   6.942   9.771
   49    HE2  LYS   7           HE3      LYS   7  -8.905   8.866  10.804
   50    HE3  LYS   7           HE2      LYS   7  -7.606   8.939   9.614
   51    HZ1  LYS   7           HZ1      LYS   7  -8.522  10.962   9.266
   52    HZ2  LYS   7           HZ2      LYS   7 -10.067  10.495   9.774
   53    HZ3  LYS   7           HZ3      LYS   7  -9.527  10.083   8.226
   54    H    LYS   8           H        LYS   8 -11.112   4.948   7.595
   55    HA   LYS   8           HA       LYS   8  -9.901   3.943   9.936
   56    HB2  LYS   8           HB3      LYS   8 -12.017   3.768  10.742
   57    HB3  LYS   8           HB2      LYS   8 -12.394   4.749   9.332
   58    HG2  LYS   8           HG3      LYS   8 -13.964   3.115   9.115
   59    HG3  LYS   8           HG2      LYS   8 -12.653   2.401   8.176
   60    HD2  LYS   8           HD3      LYS   8 -13.977   1.331  10.434
   61    HD3  LYS   8           HD2      LYS   8 -12.635   0.636   9.523
   62    HE2  LYS   8           HE3      LYS   8 -11.068   1.947  10.923
   63    HE3  LYS   8           HE2      LYS   8 -12.440   2.513  11.875
   64    HZ1  LYS   8           HZ1      LYS   8 -11.137  -0.083  11.863
   65    HZ2  LYS   8           HZ2      LYS   8 -12.824  -0.108  11.991
   66    HZ3  LYS   8           HZ3      LYS   8 -11.902   0.739  13.128
   67    H    ILE   9           H        ILE   9 -11.272   2.331   7.095
   68    HA   ILE   9           HA       ILE   9 -11.021  -0.309   8.013
   69    HB   ILE   9           HB       ILE   9 -11.196   0.920   5.289
   70   HG12  ILE   9          HG13      ILE   9 -12.891  -1.029   6.864
   71   HG13  ILE   9          HG12      ILE   9 -13.252   0.666   6.552
   72   HG21  ILE   9          HG21      ILE   9 -10.929  -1.127   4.172
   73   HG22  ILE   9          HG22      ILE   9 -10.963  -2.049   5.674
   74   HG23  ILE   9          HG23      ILE   9  -9.569  -1.041   5.292
   75   HD11  ILE   9          HD11      ILE   9 -13.254   0.047   4.092
   76   HD12  ILE   9          HD12      ILE   9 -14.596  -0.545   5.071
   77   HD13  ILE   9          HD13      ILE   9 -13.278  -1.633   4.632
   78    H    PHE  10           H        PHE  10  -8.839   1.505   6.383
   79    HA   PHE  10           HA       PHE  10  -7.001  -0.622   6.162
   80    HB2  PHE  10           HB3      PHE  10  -6.465   0.801   4.506
   81    HB3  PHE  10           HB2      PHE  10  -7.156   2.179   5.346
   82    HD1  PHE  10           HD1      PHE  10  -4.181   1.179   3.734
   83    HD2  PHE  10           HD2      PHE  10  -5.706   3.074   7.151
   84    HE1  PHE  10           HE1      PHE  10  -1.899   1.820   4.339
   85    HE2  PHE  10           HE2      PHE  10  -3.428   3.722   7.763
   86    HZ   PHE  10           HZ       PHE  10  -1.521   3.093   6.355
   87    H    VAL  11           H        VAL  11  -7.330   1.960   8.382
   88    HA   VAL  11           HA       VAL  11  -4.855   1.947   9.572
   89    HB   VAL  11           HB       VAL  11  -7.548   2.456  10.827
   90   HG11  VAL  11          HG11      VAL  11  -6.527   3.295  12.747
   91   HG12  VAL  11          HG12      VAL  11  -4.937   3.361  11.989
   92   HG13  VAL  11          HG13      VAL  11  -5.642   1.805  12.422
   93   HG21  VAL  11          HG21      VAL  11  -7.438   4.382   9.728
   94   HG22  VAL  11          HG22      VAL  11  -5.863   3.943   9.064
   95   HG23  VAL  11          HG23      VAL  11  -5.965   4.779  10.614
   96    H    GLN  12           H        GLN  12  -7.717   0.161  10.687
   97    HA   GLN  12           HA       GLN  12  -6.044  -1.290  12.652
   98    HB2  GLN  12           HB3      GLN  12  -8.186  -2.672  12.953
   99    HB3  GLN  12           HB2      GLN  12  -8.272  -0.974  13.400
  100    HG2  GLN  12           HG3      GLN  12 -10.034  -0.879  12.064
  101    HG3  GLN  12           HG2      GLN  12  -9.010  -0.998  10.737
  102   HE21  GLN  12          HE21      GLN  12  -8.268  -3.732  11.386
  103   HE22  GLN  12          HE22      GLN  12  -9.625  -4.716  10.967
  104    H    LYS  13           H        LYS  13  -7.733  -1.843   9.769
  105    HA   LYS  13           HA       LYS  13  -7.538  -4.035   8.252
  106    HB2  LYS  13           HB3      LYS  13  -8.034  -2.351   7.173
  107    HB3  LYS  13           HB2      LYS  13  -6.615  -1.443   7.665
  108    HG2  LYS  13           HG3      LYS  13  -6.119  -2.127   5.504
  109    HG3  LYS  13           HG2      LYS  13  -5.268  -3.292   6.520
  110    HD2  LYS  13           HD3      LYS  13  -6.419  -5.063   5.569
  111    HD3  LYS  13           HD2      LYS  13  -7.954  -4.298   5.985
  112    HE2  LYS  13           HE3      LYS  13  -7.099  -2.812   3.842
  113    HE3  LYS  13           HE2      LYS  13  -6.755  -4.637   3.445
  114    HZ1  LYS  13           HZ1      LYS  13  -9.320  -3.925   4.338
  115    HZ2  LYS  13           HZ2      LYS  13  -8.723  -5.252   3.477
  116    HZ3  LYS  13           HZ3      LYS  13  -8.883  -3.753   2.712
  117    H    CYS  14           H        CYS  14  -4.578  -2.291   8.946
  118    HA   CYS  14           HA       CYS  14  -2.922  -4.426   9.585
  119    HB2  CYS  14           HB3      CYS  14  -1.546  -4.850   7.678
  120    HB3  CYS  14           HB2      CYS  14  -3.218  -5.515   7.523
  121    H    ALA  15           H        ALA  15  -3.563  -1.306   9.523
  122    HA   ALA  15           HA       ALA  15  -1.328   0.077   8.622
  123    HB1  ALA  15           HB1      ALA  15  -2.729   0.791  11.202
  124    HB2  ALA  15           HB2      ALA  15  -3.513   0.949   9.591
  125    HB3  ALA  15           HB3      ALA  15  -2.034   1.843   9.940
  126    H    GLN  16           H        GLN  16  -1.476  -2.143  11.600
  127    HA   GLN  16           HA       GLN  16   0.809  -1.198  12.948
  128    HB2  GLN  16           HB3      GLN  16   0.499  -4.134  12.943
  129    HB3  GLN  16           HB2      GLN  16   0.568  -3.010  14.294
  130    HG2  GLN  16           HG3      GLN  16  -1.847  -2.305  13.623
  131    HG3  GLN  16           HG2      GLN  16  -1.853  -3.745  12.605
  132   HE21  GLN  16          HE21      GLN  16  -0.695  -3.014  15.883
  133   HE22  GLN  16          HE22      GLN  16  -1.529  -4.318  16.651
  134    H    CYS  17           H        CYS  17   0.598  -3.384  10.207
  135    HA   CYS  17           HA       CYS  17   3.391  -4.052  10.222
  136    HB2  CYS  17           HB3      CYS  17   1.560  -4.350   7.852
  137    HB3  CYS  17           HB2      CYS  17   2.946  -5.339   8.300
  138    H    HIS  18           H        HIS  18   1.486  -1.468   9.022
  139    HA   HIS  18           HA       HIS  18   3.709  -0.558   7.325
  140    HB2  HIS  18           HB3      HIS  18   0.812   0.301   7.231
  141    HB3  HIS  18           HB2      HIS  18   2.085   0.815   6.128
  142    HD1  HIS  18           HD1      HIS  18   1.809  -0.321   3.960
  143    HD2  HIS  18           HD2      HIS  18   0.828  -2.815   7.133
  144    HE1  HIS  18           HE1      HIS  18   1.198  -2.521   2.908
  145    H    THR  19           H        THR  19   3.196  -0.275  10.309
  146    HA   THR  19           HA       THR  19   3.368   1.295  11.947
  147    HB   THR  19           HB       THR  19   4.847   2.819   9.795
  148    HG1  THR  19           HG1      THR  19   6.658   1.717  10.552
  149   HG21  THR  19          HG21      THR  19   5.280   2.886  12.766
  150   HG22  THR  19          HG22      THR  19   4.373   4.104  11.867
  151   HG23  THR  19          HG23      THR  19   6.088   3.859  11.536
  152    H    VAL  20           H        VAL  20   2.750   3.429  12.685
  153    HA   VAL  20           HA       VAL  20   0.295   4.348  11.342
  154    HB   VAL  20           HB       VAL  20   1.460   5.617  13.816
  155   HG11  VAL  20          HG11      VAL  20  -0.728   6.324  12.484
  156   HG12  VAL  20          HG12      VAL  20  -0.785   6.243  14.245
  157   HG13  VAL  20          HG13      VAL  20  -1.455   4.927  13.281
  158   HG21  VAL  20          HG21      VAL  20   0.373   3.921  15.190
  159   HG22  VAL  20          HG22      VAL  20   1.639   3.177  14.131
  160   HG23  VAL  20          HG23      VAL  20  -0.137   3.035  13.752
  161    H    GLU  21           H        GLU  21   0.852   7.051  12.718
  162    HA   GLU  21           HA       GLU  21   1.584   8.447  10.376
  163    HB2  GLU  21           HB3      GLU  21   1.949  10.004  12.795
  164    HB3  GLU  21           HB2      GLU  21   0.793  10.219  11.489
  165    HG2  GLU  21           HG3      GLU  21  -0.671   8.550  12.515
  166    HG3  GLU  21           HG2      GLU  21   0.488   8.349  13.829
  167    H    LYS  22           H        LYS  22   3.497   9.560   9.839
  168    HA   LYS  22           HA       LYS  22   5.941   8.393  10.362
  169    HB2  LYS  22           HB3      LYS  22   5.272  10.080   8.530
  170    HB3  LYS  22           HB2      LYS  22   5.695  11.317   9.705
  171    HG2  LYS  22           HG3      LYS  22   7.500   9.228   8.516
  172    HG3  LYS  22           HG2      LYS  22   7.574  10.976   8.289
  173    HD2  LYS  22           HD3      LYS  22   8.069   9.480  10.862
  174    HD3  LYS  22           HD2      LYS  22   9.289  10.257   9.851
  175    HE2  LYS  22           HE3      LYS  22   8.365  12.425  10.305
  176    HE3  LYS  22           HE2      LYS  22   6.995  11.712  11.155
  177    HZ1  LYS  22           HZ1      LYS  22   9.486  12.449  12.195
  178    HZ2  LYS  22           HZ2      LYS  22   9.344  10.770  12.342
  179    HZ3  LYS  22           HZ3      LYS  22   8.166  11.779  13.014
  180    H    GLY  23           H        GLY  23   7.163   8.315  12.098
  181    HA2  GLY  23           HA3      GLY  23   8.318  10.142  13.610
  182    HA3  GLY  23           HA2      GLY  23   6.691  10.202  14.280
  183    H    GLY  24           H        GLY  24   6.217   7.348  13.868
  184    HA2  GLY  24           HA3      GLY  24   7.379   6.423  16.336
  185    HA3  GLY  24           HA2      GLY  24   6.272   5.530  15.302
  186    H    LYS  25           H        LYS  25   7.196   3.649  14.814
  187    HA   LYS  25           HA       LYS  25  10.052   3.629  14.098
  188    HB2  LYS  25           HB3      LYS  25   8.872   1.015  14.524
  189    HB3  LYS  25           HB2      LYS  25  10.298   1.734  15.259
  190    HG2  LYS  25           HG3      LYS  25   9.164   2.463  17.086
  191    HG3  LYS  25           HG2      LYS  25   7.658   2.689  16.198
  192    HD2  LYS  25           HD3      LYS  25   8.850   0.056  17.061
  193    HD3  LYS  25           HD2      LYS  25   7.441   0.849  17.768
  194    HE2  LYS  25           HE3      LYS  25   6.118  -0.100  16.259
  195    HE3  LYS  25           HE2      LYS  25   7.054   0.625  14.951
  196    HZ1  LYS  25           HZ1      LYS  25   7.069  -2.079  15.934
  197    HZ2  LYS  25           HZ2      LYS  25   8.619  -1.431  15.741
  198    HZ3  LYS  25           HZ3      LYS  25   7.553  -1.473  14.431
  199    H    HIS  26           H        HIS  26  10.729   2.252  12.347
  200    HA   HIS  26           HA       HIS  26   9.149   2.558  10.038
  201    HB2  HIS  26           HB3      HIS  26  11.041   0.457   9.631
  202    HB3  HIS  26           HB2      HIS  26  11.105   2.118   9.053
  203    HD1  HIS  26           HD1      HIS  26  11.802   0.392  12.385
  204    HD2  HIS  26           HD2      HIS  26  13.369   3.314   9.879
  205    HE1  HIS  26           HE1      HIS  26  13.901   1.193  13.515
  206    HE2  HIS  26           HE2      HIS  26  14.780   3.026  12.027
  207    H    LYS  27           H        LYS  27   7.873   1.168   8.894
  208    HA   LYS  27           HA       LYS  27   6.785  -1.072  10.382
  209    HB2  LYS  27           HB3      LYS  27   4.938  -0.926   9.015
  210    HB3  LYS  27           HB2      LYS  27   5.513   0.735   8.960
  211    HG2  LYS  27           HG3      LYS  27   6.862  -0.514   6.890
  212    HG3  LYS  27           HG2      LYS  27   5.236  -1.199   6.832
  213    HD2  LYS  27           HD3      LYS  27   5.705   0.960   5.508
  214    HD3  LYS  27           HD2      LYS  27   4.240   0.877   6.490
  215    HE2  LYS  27           HE3      LYS  27   4.905   2.574   7.772
  216    HE3  LYS  27           HE2      LYS  27   6.496   1.854   8.017
  217    HZ1  LYS  27           HZ1      LYS  27   7.299   2.853   6.051
  218    HZ2  LYS  27           HZ2      LYS  27   6.468   4.070   6.882
  219    HZ3  LYS  27           HZ3      LYS  27   5.750   3.316   5.549
  220    H    THR  28           H        THR  28   6.171  -3.050   8.968
  221    HA   THR  28           HA       THR  28   8.592  -4.281   8.146
  222    HB   THR  28           HB       THR  28   5.969  -5.449   7.353
  223    HG1  THR  28           HG1      THR  28   6.775  -5.524  10.048
  224   HG21  THR  28          HG21      THR  28   6.887  -7.537   7.883
  225   HG22  THR  28          HG22      THR  28   8.082  -6.765   9.000
  226   HG23  THR  28          HG23      THR  28   8.263  -6.651   7.228
  227    H    GLY  29           H        GLY  29   5.846  -2.900   6.410
  228    HA2  GLY  29           HA3      GLY  29   7.466  -3.007   3.952
  229    HA3  GLY  29           HA2      GLY  29   5.795  -3.549   3.923
  230    HA   PRO  30           HA       PRO  30   6.693   1.262   3.243
  231    HB2  PRO  30           HB3      PRO  30   5.638   0.342   0.555
  232    HB3  PRO  30           HB2      PRO  30   6.764   1.660   0.903
  233    HG2  PRO  30           HG3      PRO  30   7.651  -0.685  -0.005
  234    HG3  PRO  30           HG2      PRO  30   8.556   0.225   1.217
  235    HD2  PRO  30           HD3      PRO  30   6.941  -2.277   1.562
  236    HD3  PRO  30           HD2      PRO  30   8.335  -1.715   2.507
  237    H    ASN  31           H        ASN  31   5.047   2.297   4.164
  238    HA   ASN  31           HA       ASN  31   2.502   1.316   4.529
  239    HB2  ASN  31           HB3      ASN  31   3.786   3.409   5.538
  240    HB3  ASN  31           HB2      ASN  31   2.842   4.273   4.330
  241   HD21  ASN  31          HD21      ASN  31   2.162   5.168   6.551
  242   HD22  ASN  31          HD22      ASN  31   0.690   4.460   7.234
  243    H    LEU  32           H        LEU  32   3.406   3.966   2.229
  244    HA   LEU  32           HA       LEU  32   1.928   2.919   0.167
  245    HB2  LEU  32           HB3      LEU  32   0.031   4.428  -0.096
  246    HB3  LEU  32           HB2      LEU  32  -0.006   3.468   1.373
  247    HG   LEU  32           HG       LEU  32  -1.023   5.597   1.936
  248   HD11  LEU  32          HD11      LEU  32   1.641   5.225   2.877
  249   HD12  LEU  32          HD12      LEU  32   0.214   4.544   3.656
  250   HD13  LEU  32          HD13      LEU  32   0.481   6.286   3.677
  251   HD21  LEU  32          HD21      LEU  32  -0.250   7.559   1.174
  252   HD22  LEU  32          HD22      LEU  32   0.420   6.483  -0.052
  253   HD23  LEU  32          HD23      LEU  32   1.411   7.001   1.318
  254    H    HIS  33           H        HIS  33   3.432   5.629   1.703
  255    HA   HIS  33           HA       HIS  33   3.532   7.589  -0.204
  256    HB2  HIS  33           HB3      HIS  33   4.830   7.076   2.216
  257    HB3  HIS  33           HB2      HIS  33   6.132   7.267   1.047
  258    HD1  HIS  33           HD1      HIS  33   6.782   9.509   2.234
  259    HD2  HIS  33           HD2      HIS  33   3.007   9.485   0.498
  260    HE1  HIS  33           HE1      HIS  33   6.066  11.917   2.149
  261    HE2  HIS  33           HE2      HIS  33   3.744  11.870   1.174
  262    H    GLY  34           H        GLY  34   4.284   7.703  -2.211
  263    HA2  GLY  34           HA3      GLY  34   5.598   7.333  -4.066
  264    HA3  GLY  34           HA2      GLY  34   6.753   6.524  -3.018
  265    H    LEU  35           H        LEU  35   3.558   5.334  -2.846
  266    HA   LEU  35           HA       LEU  35   4.266   2.746  -3.653
  267    HB2  LEU  35           HB3      LEU  35   2.335   3.332  -2.198
  268    HB3  LEU  35           HB2      LEU  35   1.504   3.963  -3.607
  269    HG   LEU  35           HG       LEU  35   1.426   1.755  -4.609
  270   HD11  LEU  35          HD11      LEU  35   2.564  -0.108  -3.924
  271   HD12  LEU  35          HD12      LEU  35   2.440   0.392  -2.195
  272   HD13  LEU  35          HD13      LEU  35   3.645   1.172  -3.220
  273   HD21  LEU  35          HD21      LEU  35   0.369   2.081  -1.808
  274   HD22  LEU  35          HD22      LEU  35   0.077   0.591  -2.703
  275   HD23  LEU  35          HD23      LEU  35  -0.528   2.125  -3.326
  276    H    PHE  36           H        PHE  36   2.486   5.290  -5.382
  277    HA   PHE  36           HA       PHE  36   2.850   3.757  -7.867
  278    HB2  PHE  36           HB3      PHE  36   0.929   6.088  -7.770
  279    HB3  PHE  36           HB2      PHE  36   0.793   4.573  -8.658
  280    HD1  PHE  36           HD1      PHE  36  -0.278   2.608  -7.719
  281    HD2  PHE  36           HD2      PHE  36   0.284   6.212  -5.414
  282    HE1  PHE  36           HE1      PHE  36  -1.829   1.751  -6.014
  283    HE2  PHE  36           HE2      PHE  36  -1.268   5.360  -3.705
  284    HZ   PHE  36           HZ       PHE  36  -2.322   3.153  -3.991
  285    H    GLY  37           H        GLY  37   4.590   5.818  -6.334
  286    HA2  GLY  37           HA3      GLY  37   5.136   7.503  -8.701
  287    HA3  GLY  37           HA2      GLY  37   5.257   8.123  -7.061
  288    H    ARG  38           H        ARG  38   6.471   5.822  -5.882
  289    HA   ARG  38           HA       ARG  38   9.177   6.267  -6.848
  290    HB2  ARG  38           HB3      ARG  38   8.092   4.862  -4.405
  291    HB3  ARG  38           HB2      ARG  38   9.805   4.958  -4.793
  292    HG2  ARG  38           HG3      ARG  38   9.491   7.485  -4.820
  293    HG3  ARG  38           HG2      ARG  38   7.935   7.180  -4.047
  294    HD2  ARG  38           HD3      ARG  38   8.912   6.897  -2.070
  295    HD3  ARG  38           HD2      ARG  38   9.996   5.676  -2.732
  296    HE   ARG  38           HE       ARG  38  11.612   7.251  -2.444
  297   HH11  ARG  38          HH11      ARG  38   8.697   8.850  -3.477
  298   HH12  ARG  38          HH12      ARG  38   9.433  10.415  -3.569
  299   HH21  ARG  38          HH21      ARG  38  12.592   9.306  -2.560
  300   HH22  ARG  38          HH22      ARG  38  11.648  10.674  -3.047
  301    H    LYS  39           H        LYS  39  10.676   4.308  -6.849
  302    HA   LYS  39           HA       LYS  39   9.918   2.559  -8.855
  303    HB2  LYS  39           HB3      LYS  39  12.263   2.999  -8.240
  304    HB3  LYS  39           HB2      LYS  39  12.037   2.090  -6.753
  305    HG2  LYS  39           HG3      LYS  39  13.014   1.072  -9.082
  306    HG3  LYS  39           HG2      LYS  39  12.302   0.118  -7.780
  307    HD2  LYS  39           HD3      LYS  39  11.335  -0.482  -9.939
  308    HD3  LYS  39           HD2      LYS  39  10.120   0.245  -8.887
  309    HE2  LYS  39           HE3      LYS  39  10.719   2.443 -10.057
  310    HE3  LYS  39           HE2      LYS  39  11.495   1.430 -11.271
  311    HZ1  LYS  39           HZ1      LYS  39   9.520   0.660 -12.024
  312    HZ2  LYS  39           HZ2      LYS  39   8.970   2.149 -11.438
  313    HZ3  LYS  39           HZ3      LYS  39   8.761   0.748 -10.514
  314    H    THR  40           H        THR  40  11.017   0.893  -6.008
  315    HA   THR  40           HA       THR  40   8.443  -0.013  -5.203
  316    HB   THR  40           HB       THR  40   8.948  -2.281  -4.976
  317    HG1  THR  40           HG1      THR  40  10.422  -3.476  -5.880
  318   HG21  THR  40          HG21      THR  40   8.620  -2.039  -7.727
  319   HG22  THR  40          HG22      THR  40   8.906  -2.876  -6.516
  320   HG23  THR  40          HG23      THR  40   7.515  -2.894  -6.213
  321    H    GLY  41           H        GLY  41   8.352   0.382  -3.433
  322    HA2  GLY  41           HA3      GLY  41   8.839   0.388  -1.190
  323    HA3  GLY  41           HA2      GLY  41   9.491  -1.217  -1.477
  324    H    GLN  42           H        GLN  42  10.728   1.809  -2.818
  325    HA   GLN  42           HA       GLN  42  13.279   1.251  -1.483
  326    HB2  GLN  42           HB3      GLN  42  13.788   3.308  -3.223
  327    HB3  GLN  42           HB2      GLN  42  14.029   1.601  -3.570
  328    HG2  GLN  42           HG3      GLN  42  12.803   2.800  -5.339
  329    HG3  GLN  42           HG2      GLN  42  11.894   1.457  -4.648
  330   HE21  GLN  42          HE21      GLN  42   9.833   1.976  -4.658
  331   HE22  GLN  42          HE22      GLN  42   9.158   3.480  -4.140
  332    H    ALA  43           H        ALA  43  11.351   2.292   0.178
  333    HA   ALA  43           HA       ALA  43  11.164   5.046   0.412
  334    HB1  ALA  43           HB1      ALA  43  11.262   4.176   3.030
  335    HB2  ALA  43           HB2      ALA  43  10.725   2.753   2.137
  336    HB3  ALA  43           HB3      ALA  43   9.824   4.265   2.012
  337    HA   PRO  44           HA       PRO  44  15.014   6.496   2.004
  338    HB2  PRO  44           HB3      PRO  44  14.393   8.146   4.021
  339    HB3  PRO  44           HB2      PRO  44  13.893   8.489   2.361
  340    HG2  PRO  44           HG3      PRO  44  12.304   7.323   4.613
  341    HG3  PRO  44           HG2      PRO  44  11.826   8.546   3.422
  342    HD2  PRO  44           HD3      PRO  44  11.168   5.885   3.243
  343    HD3  PRO  44           HD2      PRO  44  11.291   6.973   1.846
  344    H    GLY  45           H        GLY  45  14.108   7.022   5.226
  345    HA2  GLY  45           HA3      GLY  45  16.122   5.275   6.225
  346    HA3  GLY  45           HA2      GLY  45  14.989   6.208   7.190
  347    H    PHE  46           H        PHE  46  13.293   4.404   4.973
  348    HA   PHE  46           HA       PHE  46  12.363   2.595   7.020
  349    HB2  PHE  46           HB3      PHE  46  10.761   3.635   5.485
  350    HB3  PHE  46           HB2      PHE  46  11.559   2.865   4.117
  351    HD1  PHE  46           HD1      PHE  46   9.742   2.122   7.264
  352    HD2  PHE  46           HD2      PHE  46  10.913   0.745   3.414
  353    HE1  PHE  46           HE1      PHE  46   8.283   0.158   7.528
  354    HE2  PHE  46           HE2      PHE  46   9.457  -1.220   3.670
  355    HZ   PHE  46           HZ       PHE  46   8.139  -1.517   5.728
  356    H    THR  47           H        THR  47  12.788   0.462   7.211
  357    HA   THR  47           HA       THR  47  14.974  -0.613   5.675
  358    HB   THR  47           HB       THR  47  14.027  -1.013   8.241
  359    HG1  THR  47           HG1      THR  47  15.716  -2.542   8.327
  360   HG21  THR  47          HG21      THR  47  13.684  -3.484   8.336
  361   HG22  THR  47          HG22      THR  47  13.412  -3.448   6.595
  362   HG23  THR  47          HG23      THR  47  12.331  -2.565   7.675
  363    H    TYR  48           H        TYR  48  14.446  -1.121   3.636
  364    HA   TYR  48           HA       TYR  48  11.936  -2.246   2.882
  365    HB2  TYR  48           HB3      TYR  48  13.871  -2.726   0.859
  366    HB3  TYR  48           HB2      TYR  48  12.607  -1.503   0.886
  367    HD1  TYR  48           HD1      TYR  48  16.038  -2.115   2.235
  368    HD2  TYR  48           HD2      TYR  48  13.230   0.725   0.768
  369    HE1  TYR  48           HE1      TYR  48  17.758  -0.363   2.352
  370    HE2  TYR  48           HE2      TYR  48  14.943   2.485   0.880
  371    HH   TYR  48           HH       TYR  48  18.042   1.940   2.385
  372    H    THR  49           H        THR  49  11.656  -4.286   1.792
  373    HA   THR  49           HA       THR  49  12.912  -6.453   3.222
  374    HB   THR  49           HB       THR  49  11.307  -7.874   2.122
  375    HG1  THR  49           HG1      THR  49   9.876  -6.795   0.532
  376   HG21  THR  49          HG21      THR  49   9.411  -5.706   2.292
  377   HG22  THR  49          HG22      THR  49  10.510  -5.729   3.670
  378   HG23  THR  49          HG23      THR  49   9.560  -7.161   3.277
  379    H    ASP  50           H        ASP  50  13.576  -8.437   1.823
  380    HA   ASP  50           HA       ASP  50  15.853  -7.774   0.389
  381    HB2  ASP  50           HB3      ASP  50  15.875  -9.987   1.045
  382    HB3  ASP  50           HB2      ASP  50  14.184 -10.238   0.626
  383    H    ALA  51           H        ALA  51  12.546  -8.234  -0.705
  384    HA   ALA  51           HA       ALA  51  13.127  -8.167  -3.491
  385    HB1  ALA  51           HB1      ALA  51  11.002  -8.791  -3.619
  386    HB2  ALA  51           HB2      ALA  51  10.481  -7.238  -2.969
  387    HB3  ALA  51           HB3      ALA  51  10.849  -8.572  -1.876
  388    H    ASN  52           H        ASN  52  12.031  -5.716  -1.160
  389    HA   ASN  52           HA       ASN  52  11.734  -3.602  -2.978
  390    HB2  ASN  52           HB3      ASN  52  12.445  -3.540  -0.038
  391    HB3  ASN  52           HB2      ASN  52  11.966  -2.130  -0.980
  392   HD21  ASN  52          HD21      ASN  52  10.173  -4.196  -2.459
  393   HD22  ASN  52          HD22      ASN  52   8.765  -4.254  -1.458
  394    H    LYS  53           H        LYS  53  14.519  -4.626  -1.043
  395    HA   LYS  53           HA       LYS  53  16.262  -2.553  -1.748
  396    HB2  LYS  53           HB3      LYS  53  18.072  -4.258  -1.228
  397    HB3  LYS  53           HB2      LYS  53  16.904  -3.957   0.052
  398    HG2  LYS  53           HG3      LYS  53  15.767  -5.999  -0.403
  399    HG3  LYS  53           HG2      LYS  53  16.714  -6.264  -1.868
  400    HD2  LYS  53           HD3      LYS  53  17.849  -7.623  -0.421
  401    HD3  LYS  53           HD2      LYS  53  18.731  -6.116  -0.168
  402    HE2  LYS  53           HE3      LYS  53  18.213  -6.191   1.987
  403    HE3  LYS  53           HE2      LYS  53  16.504  -6.085   1.570
  404    HZ1  LYS  53           HZ1      LYS  53  18.002  -8.324   2.522
  405    HZ2  LYS  53           HZ2      LYS  53  17.157  -8.696   1.105
  406    HZ3  LYS  53           HZ3      LYS  53  16.326  -8.101   2.455
  407    H    ASN  54           H        ASN  54  15.282  -5.449  -3.418
  408    HA   ASN  54           HA       ASN  54  17.328  -5.326  -5.426
  409    HB2  ASN  54           HB3      ASN  54  14.690  -6.811  -5.420
  410    HB3  ASN  54           HB2      ASN  54  16.003  -7.062  -6.565
  411   HD21  ASN  54          HD21      ASN  54  17.353  -6.337  -3.657
  412   HD22  ASN  54          HD22      ASN  54  17.621  -7.934  -3.057
  413    H    LYS  55           H        LYS  55  14.405  -3.705  -4.839
  414    HA   LYS  55           HA       LYS  55  13.381  -2.001  -5.958
  415    HB2  LYS  55           HB3      LYS  55  15.680  -2.456  -7.849
  416    HB3  LYS  55           HB2      LYS  55  14.414  -1.287  -8.194
  417    HG2  LYS  55           HG3      LYS  55  15.230   0.202  -6.745
  418    HG3  LYS  55           HG2      LYS  55  15.559  -1.026  -5.520
  419    HD2  LYS  55           HD3      LYS  55  17.271  -0.201  -7.849
  420    HD3  LYS  55           HD2      LYS  55  17.666  -0.164  -6.128
  421    HE2  LYS  55           HE3      LYS  55  17.270  -2.744  -6.293
  422    HE3  LYS  55           HE2      LYS  55  17.570  -2.479  -8.009
  423    HZ1  LYS  55           HZ1      LYS  55  19.646  -2.972  -7.115
  424    HZ2  LYS  55           HZ2      LYS  55  19.399  -2.026  -5.735
  425    HZ3  LYS  55           HZ3      LYS  55  19.660  -1.284  -7.232
  426    H    GLY  56           H        GLY  56  11.917  -4.048  -6.024
  427    HA2  GLY  56           HA3      GLY  56  11.494  -5.521  -8.334
  428    HA3  GLY  56           HA2      GLY  56  10.242  -5.111  -7.173
  429    H    ILE  57           H        ILE  57   8.667  -3.729  -7.776
  430    HA   ILE  57           HA       ILE  57   9.163  -1.896  -9.960
  431    HB   ILE  57           HB       ILE  57   8.014  -4.298 -10.581
  432   HG12  ILE  57          HG13      ILE  57   8.893  -3.157 -12.331
  433   HG13  ILE  57          HG12      ILE  57   7.194  -2.802 -12.619
  434   HG21  ILE  57          HG21      ILE  57   5.929  -3.948  -9.571
  435   HG22  ILE  57          HG22      ILE  57   5.680  -3.564 -11.273
  436   HG23  ILE  57          HG23      ILE  57   5.869  -2.266 -10.095
  437   HD11  ILE  57          HD11      ILE  57   7.423  -0.630 -12.057
  438   HD12  ILE  57          HD12      ILE  57   9.083  -0.934 -12.571
  439   HD13  ILE  57          HD13      ILE  57   8.669  -0.959 -10.854
  440    H    THR  58           H        THR  58   7.178  -0.507 -10.396
  441    HA   THR  58           HA       THR  58   6.298   0.543  -7.873
  442    HB   THR  58           HB       THR  58   6.750   1.578 -10.442
  443    HG1  THR  58           HG1      THR  58   6.269   3.547  -9.368
  444   HG21  THR  58          HG21      THR  58   4.393   1.062 -10.987
  445   HG22  THR  58          HG22      THR  58   4.764   2.785 -11.005
  446   HG23  THR  58          HG23      THR  58   3.897   2.086  -9.638
  447    H    TRP  59           H        TRP  59   4.628  -0.232  -6.859
  448    HA   TRP  59           HA       TRP  59   2.676  -1.925  -8.008
  449    HB2  TRP  59           HB3      TRP  59   2.001  -0.538  -5.482
  450    HB3  TRP  59           HB2      TRP  59   1.986  -2.259  -5.865
  451    HD1  TRP  59           HD1      TRP  59   4.441   0.531  -4.827
  452    HE1  TRP  59           HE1      TRP  59   6.484  -0.567  -3.713
  453    HE3  TRP  59           HE3      TRP  59   3.263  -4.381  -5.624
  454    HZ2  TRP  59           HZ2      TRP  59   7.467  -3.168  -3.232
  455    HZ3  TRP  59           HZ3      TRP  59   4.809  -6.113  -4.806
  456    HH2  TRP  59           HH2      TRP  59   6.867  -5.517  -3.634
  457    H    LYS  60           H        LYS  60   1.267  -1.235  -9.461
  458    HA   LYS  60           HA       LYS  60   0.051   1.418  -9.152
  459    HB2  LYS  60           HB3      LYS  60   0.386   1.574 -11.355
  460    HB3  LYS  60           HB2      LYS  60   0.983  -0.079 -11.407
  461    HG2  LYS  60           HG3      LYS  60  -0.746  -0.383 -12.799
  462    HG3  LYS  60           HG2      LYS  60  -1.673  -0.534 -11.306
  463    HD2  LYS  60           HD3      LYS  60  -2.777   1.383 -11.669
  464    HD3  LYS  60           HD2      LYS  60  -1.317   2.229 -12.188
  465    HE2  LYS  60           HE3      LYS  60  -1.975   0.321 -14.181
  466    HE3  LYS  60           HE2      LYS  60  -3.447   1.204 -13.773
  467    HZ1  LYS  60           HZ1      LYS  60  -1.514   2.053 -15.475
  468    HZ2  LYS  60           HZ2      LYS  60  -1.153   2.903 -14.060
  469    HZ3  LYS  60           HZ3      LYS  60  -2.687   3.037 -14.756
  470    H    GLU  61           H        GLU  61  -2.300   1.481 -10.001
  471    HA   GLU  61           HA       GLU  61  -3.893  -0.032  -8.259
  472    HB2  GLU  61           HB3      GLU  61  -4.265   2.169  -9.902
  473    HB3  GLU  61           HB2      GLU  61  -5.328   0.953 -10.597
  474    HG2  GLU  61           HG3      GLU  61  -5.625   0.926  -7.765
  475    HG3  GLU  61           HG2      GLU  61  -5.770   2.585  -8.343
  476    H    GLU  62           H        GLU  62  -3.669  -0.242 -11.816
  477    HA   GLU  62           HA       GLU  62  -5.264  -2.544 -12.062
  478    HB2  GLU  62           HB3      GLU  62  -4.770  -2.475 -14.307
  479    HB3  GLU  62           HB2      GLU  62  -4.401  -0.821 -13.845
  480    HG2  GLU  62           HG3      GLU  62  -2.020  -1.456 -13.637
  481    HG3  GLU  62           HG2      GLU  62  -2.434  -3.062 -14.234
  482    H    THR  63           H        THR  63  -1.749  -2.159 -11.821
  483    HA   THR  63           HA       THR  63  -1.088  -4.871 -12.207
  484    HB   THR  63           HB       THR  63   0.297  -2.467 -11.695
  485    HG1  THR  63           HG1      THR  63   1.615  -3.515 -12.924
  486   HG21  THR  63          HG21      THR  63   1.790  -2.818  -9.991
  487   HG22  THR  63          HG22      THR  63   1.486  -4.555  -9.937
  488   HG23  THR  63          HG23      THR  63   0.294  -3.431  -9.287
  489    H    LEU  64           H        LEU  64  -2.203  -3.086  -9.450
  490    HA   LEU  64           HA       LEU  64  -1.463  -4.996  -7.468
  491    HB2  LEU  64           HB3      LEU  64  -2.918  -2.471  -7.593
  492    HB3  LEU  64           HB2      LEU  64  -3.624  -3.598  -6.451
  493    HG   LEU  64           HG       LEU  64  -0.774  -2.604  -6.442
  494   HD11  LEU  64          HD11      LEU  64  -1.855  -0.852  -5.499
  495   HD12  LEU  64          HD12      LEU  64  -1.773  -1.888  -4.073
  496   HD13  LEU  64          HD13      LEU  64  -3.251  -1.822  -5.031
  497   HD21  LEU  64          HD21      LEU  64  -0.485  -3.866  -4.411
  498   HD22  LEU  64          HD22      LEU  64  -0.992  -4.955  -5.702
  499   HD23  LEU  64          HD23      LEU  64  -2.153  -4.433  -4.481
  500    H    MET  65           H        MET  65  -4.275  -4.460  -9.497
  501    HA   MET  65           HA       MET  65  -6.087  -6.160  -8.198
  502    HB2  MET  65           HB3      MET  65  -5.816  -5.334 -11.086
  503    HB3  MET  65           HB2      MET  65  -7.131  -6.352 -10.518
  504    HG2  MET  65           HG3      MET  65  -6.526  -3.516  -9.740
  505    HG3  MET  65           HG2      MET  65  -7.938  -4.128 -10.601
  506    HE1  MET  65           HE1      MET  65  -6.444  -3.059  -7.390
  507    HE2  MET  65           HE2      MET  65  -6.000  -4.744  -7.119
  508    HE3  MET  65           HE3      MET  65  -7.233  -3.983  -6.112
  509    H    GLU  66           H        GLU  66  -3.681  -6.800 -10.708
  510    HA   GLU  66           HA       GLU  66  -4.342  -9.595 -10.881
  511    HB2  GLU  66           HB3      GLU  66  -2.111  -9.630 -12.186
  512    HB3  GLU  66           HB2      GLU  66  -3.468  -8.752 -12.877
  513    HG2  GLU  66           HG3      GLU  66  -2.552  -6.655 -12.118
  514    HG3  GLU  66           HG2      GLU  66  -1.234  -7.497 -11.299
  515    H    TYR  67           H        TYR  67  -1.931  -7.618  -9.268
  516    HA   TYR  67           HA       TYR  67  -0.231  -9.666  -8.373
  517    HB2  TYR  67           HB3      TYR  67   0.770  -7.640  -8.043
  518    HB3  TYR  67           HB2      TYR  67  -0.743  -6.838  -7.643
  519    HD1  TYR  67           HD1      TYR  67   2.155  -8.598  -6.337
  520    HD2  TYR  67           HD2      TYR  67  -1.647  -6.963  -5.351
  521    HE1  TYR  67           HE1      TYR  67   2.742  -8.685  -3.951
  522    HE2  TYR  67           HE2      TYR  67  -1.068  -7.044  -2.962
  523    HH   TYR  67           HH       TYR  67   0.756  -7.203  -1.513
  524    H    LEU  68           H        LEU  68  -3.358  -8.656  -7.337
  525    HA   LEU  68           HA       LEU  68  -3.326  -9.538  -4.673
  526    HB2  LEU  68           HB3      LEU  68  -5.502  -9.166  -6.705
  527    HB3  LEU  68           HB2      LEU  68  -5.861  -9.846  -5.129
  528    HG   LEU  68           HG       LEU  68  -4.565  -7.152  -5.543
  529   HD11  LEU  68          HD11      LEU  68  -6.684  -6.152  -5.137
  530   HD12  LEU  68          HD12      LEU  68  -7.429  -7.717  -4.804
  531   HD13  LEU  68          HD13      LEU  68  -6.898  -7.323  -6.440
  532   HD21  LEU  68          HD21      LEU  68  -4.046  -8.145  -3.398
  533   HD22  LEU  68          HD22      LEU  68  -5.753  -8.488  -3.115
  534   HD23  LEU  68          HD23      LEU  68  -5.188  -6.818  -3.184
  535    H    GLU  69           H        GLU  69  -3.207 -11.278  -7.589
  536    HA   GLU  69           HA       GLU  69  -4.553 -13.642  -6.911
  537    HB2  GLU  69           HB3      GLU  69  -3.171 -12.726  -9.105
  538    HB3  GLU  69           HB2      GLU  69  -2.134 -14.022  -8.522
  539    HG2  GLU  69           HG3      GLU  69  -3.996 -15.581  -8.626
  540    HG3  GLU  69           HG2      GLU  69  -5.062 -14.286  -9.166
  541    H    ASN  70           H        ASN  70  -1.026 -13.556  -7.228
  542    HA   ASN  70           HA       ASN  70  -0.849 -15.123  -4.738
  543    HB2  ASN  70           HB3      ASN  70   0.555 -15.412  -7.367
  544    HB3  ASN  70           HB2      ASN  70   1.377 -15.917  -5.893
  545   HD21  ASN  70          HD21      ASN  70  -0.968 -16.689  -8.231
  546   HD22  ASN  70          HD22      ASN  70  -1.504 -18.180  -7.544
  547    HA   PRO  71           HA       PRO  71   1.206 -11.156  -3.680
  548    HB2  PRO  71           HB3      PRO  71   1.181 -12.654  -1.100
  549    HB3  PRO  71           HB2      PRO  71   0.765 -10.967  -1.427
  550    HG2  PRO  71           HG3      PRO  71  -1.142 -12.774  -0.999
  551    HG3  PRO  71           HG2      PRO  71  -1.348 -11.502  -2.218
  552    HD2  PRO  71           HD3      PRO  71  -0.736 -14.397  -2.585
  553    HD3  PRO  71           HD2      PRO  71  -1.708 -13.311  -3.598
  554    H    LYS  72           H        LYS  72   2.120 -14.478  -2.940
  555    HA   LYS  72           HA       LYS  72   4.842 -13.796  -2.300
  556    HB2  LYS  72           HB3      LYS  72   4.822 -15.825  -1.371
  557    HB3  LYS  72           HB2      LYS  72   3.171 -16.036  -1.937
  558    HG2  LYS  72           HG3      LYS  72   4.159 -17.876  -2.851
  559    HG3  LYS  72           HG2      LYS  72   4.366 -16.724  -4.171
  560    HD2  LYS  72           HD3      LYS  72   6.559 -16.474  -2.355
  561    HD3  LYS  72           HD2      LYS  72   6.358 -18.174  -2.788
  562    HE2  LYS  72           HE3      LYS  72   6.038 -16.701  -5.163
  563    HE3  LYS  72           HE2      LYS  72   7.441 -16.020  -4.340
  564    HZ1  LYS  72           HZ1      LYS  72   8.405 -18.220  -4.208
  565    HZ2  LYS  72           HZ2      LYS  72   8.043 -17.848  -5.818
  566    HZ3  LYS  72           HZ3      LYS  72   7.044 -18.900  -4.950
  567    H    LYS  73           H        LYS  73   3.049 -14.582  -5.137
  568    HA   LYS  73           HA       LYS  73   5.208 -15.517  -6.734
  569    HB2  LYS  73           HB3      LYS  73   3.699 -15.588  -8.482
  570    HB3  LYS  73           HB2      LYS  73   2.622 -15.697  -7.097
  571    HG2  LYS  73           HG3      LYS  73   1.510 -14.081  -8.196
  572    HG3  LYS  73           HG2      LYS  73   2.689 -13.032  -7.406
  573    HD2  LYS  73           HD3      LYS  73   2.322 -12.734  -9.926
  574    HD3  LYS  73           HD2      LYS  73   3.986 -12.836  -9.344
  575    HE2  LYS  73           HE3      LYS  73   3.454 -14.190 -11.406
  576    HE3  LYS  73           HE2      LYS  73   4.205 -15.074 -10.077
  577    HZ1  LYS  73           HZ1      LYS  73   1.861 -15.703  -9.423
  578    HZ2  LYS  73           HZ2      LYS  73   2.461 -16.420 -10.832
  579    HZ3  LYS  73           HZ3      LYS  73   1.374 -15.128 -10.938
  580    H    TYR  74           H        TYR  74   3.961 -12.359  -5.930
  581    HA   TYR  74           HA       TYR  74   5.474 -11.008  -7.984
  582    HB2  TYR  74           HB3      TYR  74   3.534 -10.236  -5.887
  583    HB3  TYR  74           HB2      TYR  74   4.734  -9.016  -6.307
  584    HD1  TYR  74           HD1      TYR  74   2.219 -11.294  -7.851
  585    HD2  TYR  74           HD2      TYR  74   4.391  -7.648  -8.159
  586    HE1  TYR  74           HE1      TYR  74   0.887 -10.675  -9.823
  587    HE2  TYR  74           HE2      TYR  74   3.064  -7.019 -10.132
  588    HH   TYR  74           HH       TYR  74   0.812  -9.252 -11.622
  589    H    ILE  75           H        ILE  75   5.685 -11.420  -4.467
  590    HA   ILE  75           HA       ILE  75   8.517 -10.651  -4.635
  591    HB   ILE  75           HB       ILE  75   6.504  -9.687  -2.612
  592   HG12  ILE  75          HG13      ILE  75   6.584  -8.147  -4.364
  593   HG13  ILE  75          HG12      ILE  75   7.762  -7.495  -3.229
  594   HG21  ILE  75          HG21      ILE  75   8.524  -8.651  -1.482
  595   HG22  ILE  75          HG22      ILE  75   9.501  -9.784  -2.415
  596   HG23  ILE  75          HG23      ILE  75   8.306 -10.387  -1.268
  597   HD11  ILE  75          HD11      ILE  75   9.082  -7.377  -5.025
  598   HD12  ILE  75          HD12      ILE  75   8.128  -8.556  -5.928
  599   HD13  ILE  75          HD13      ILE  75   9.326  -9.102  -4.754
  600    HA   PRO  76           HA       PRO  76   7.991 -14.861  -2.724
  601    HB2  PRO  76           HB3      PRO  76  10.697 -15.073  -3.920
  602    HB3  PRO  76           HB2      PRO  76   9.340 -16.201  -4.001
  603    HG2  PRO  76           HG3      PRO  76  10.018 -14.718  -6.113
  604    HG3  PRO  76           HG2      PRO  76   8.318 -15.052  -5.736
  605    HD2  PRO  76           HD3      PRO  76   9.911 -12.564  -5.272
  606    HD3  PRO  76           HD2      PRO  76   8.220 -12.742  -5.791
  607    H    GLY  77           H        GLY  77   8.629 -15.309  -0.702
  608    HA2  GLY  77           HA3      GLY  77  10.370 -15.553   0.948
  609    HA3  GLY  77           HA2      GLY  77  11.149 -14.133   0.268
  610    H    THR  78           H        THR  78   8.288 -12.950   0.151
  611    HA   THR  78           HA       THR  78   8.379 -11.910   2.890
  612    HB   THR  78           HB       THR  78   8.210 -10.602   0.479
  613    HG1  THR  78           HG1      THR  78   7.232  -9.613   2.945
  614   HG21  THR  78          HG21      THR  78   5.770 -11.379   0.421
  615   HG22  THR  78          HG22      THR  78   6.115  -9.672   0.145
  616   HG23  THR  78          HG23      THR  78   5.519 -10.209   1.716
  617    H    LYS  79           H        LYS  79   6.856 -12.385   4.328
  618    HA   LYS  79           HA       LYS  79   4.445 -13.779   3.385
  619    HB2  LYS  79           HB3      LYS  79   6.153 -14.822   5.067
  620    HB3  LYS  79           HB2      LYS  79   5.351 -13.787   6.242
  621    HG2  LYS  79           HG3      LYS  79   4.557 -16.232   5.921
  622    HG3  LYS  79           HG2      LYS  79   3.366 -14.943   6.111
  623    HD2  LYS  79           HD3      LYS  79   2.830 -16.543   4.283
  624    HD3  LYS  79           HD2      LYS  79   2.982 -14.868   3.742
  625    HE2  LYS  79           HE3      LYS  79   4.085 -16.505   2.237
  626    HE3  LYS  79           HE2      LYS  79   5.182 -15.284   2.879
  627    HZ1  LYS  79           HZ1      LYS  79   6.079 -17.580   2.914
  628    HZ2  LYS  79           HZ2      LYS  79   4.880 -18.003   4.030
  629    HZ3  LYS  79           HZ3      LYS  79   6.044 -16.845   4.438
  630    H    MET  80           H        MET  80   2.410 -13.063   4.077
  631    HA   MET  80           HA       MET  80   2.447 -10.427   5.377
  632    HB2  MET  80           HB3      MET  80   1.334 -10.797   3.093
  633    HB3  MET  80           HB2      MET  80   0.083 -11.662   3.978
  634    HG2  MET  80           HG3      MET  80  -0.844  -9.590   3.902
  635    HG3  MET  80           HG2      MET  80   0.043  -9.469   5.420
  636    HE1  MET  80           HE1      MET  80   2.115  -9.565   2.128
  637    HE2  MET  80           HE2      MET  80   1.927  -7.923   1.512
  638    HE3  MET  80           HE3      MET  80   0.544  -9.015   1.548
  639    H    ILE  81           H        ILE  81   2.137 -10.510   7.096
  640    HA   ILE  81           HA       ILE  81   0.342 -12.567   8.594
  641    HB   ILE  81           HB       ILE  81   2.332 -10.663   9.936
  642   HG12  ILE  81          HG13      ILE  81   3.234 -13.125  10.457
  643   HG13  ILE  81          HG12      ILE  81   2.307 -13.496   9.003
  644   HG21  ILE  81          HG21      ILE  81   1.308 -12.920  11.525
  645   HG22  ILE  81          HG22      ILE  81   0.179 -11.572  11.288
  646   HG23  ILE  81          HG23      ILE  81   1.768 -11.290  12.014
  647   HD11  ILE  81          HD11      ILE  81   4.360 -13.045   8.107
  648   HD12  ILE  81          HD12      ILE  81   4.751 -11.832   9.328
  649   HD13  ILE  81          HD13      ILE  81   3.618 -11.443   8.038
  650    H    PHE  82           H        PHE  82  -1.632 -11.941   9.746
  651    HA   PHE  82           HA       PHE  82  -3.168 -10.627  10.866
  652    HB2  PHE  82           HB3      PHE  82  -1.072  -9.157  11.408
  653    HB3  PHE  82           HB2      PHE  82  -1.700  -8.117  10.135
  654    HD1  PHE  82           HD1      PHE  82  -2.302  -9.470  13.486
  655    HD2  PHE  82           HD2      PHE  82  -3.706  -6.837  10.450
  656    HE1  PHE  82           HE1      PHE  82  -3.839  -8.432  15.102
  657    HE2  PHE  82           HE2      PHE  82  -5.245  -5.793  12.061
  658    HZ   PHE  82           HZ       PHE  82  -5.312  -6.591  14.390
  659    H    ALA  83           H        ALA  83  -4.827  -8.975  10.250
  660    HA   ALA  83           HA       ALA  83  -5.363  -7.538   8.169
  661    HB1  ALA  83           HB1      ALA  83  -6.100  -9.328   6.358
  662    HB2  ALA  83           HB2      ALA  83  -4.812 -10.261   7.120
  663    HB3  ALA  83           HB3      ALA  83  -4.460  -8.681   6.417
  664    H    GLY  84           H        GLY  84  -7.054  -7.098   9.613
  665    HA2  GLY  84           HA3      GLY  84  -9.079  -9.080  10.149
  666    HA3  GLY  84           HA2      GLY  84  -9.108  -7.396  10.649
  667    H    ILE  85           H        ILE  85  -8.472  -7.854   7.344
  668    HA   ILE  85           HA       ILE  85 -11.308  -7.497   6.650
  669    HB   ILE  85           HB       ILE  85  -9.013  -5.885   5.533
  670   HG12  ILE  85          HG13      ILE  85 -10.535  -5.464   7.828
  671   HG13  ILE  85          HG12      ILE  85  -9.559  -4.265   6.987
  672   HG21  ILE  85          HG21      ILE  85 -11.939  -5.822   4.812
  673   HG22  ILE  85          HG22      ILE  85 -10.642  -6.473   3.810
  674   HG23  ILE  85          HG23      ILE  85 -10.691  -4.748   4.179
  675   HD11  ILE  85          HD11      ILE  85 -11.692  -3.954   5.535
  676   HD12  ILE  85          HD12      ILE  85 -11.591  -3.211   7.132
  677   HD13  ILE  85          HD13      ILE  85 -12.501  -4.704   6.909
  678    H    LYS  86           H        LYS  86 -11.943  -8.305   4.649
  679    HA   LYS  86           HA       LYS  86  -9.971  -9.565   2.932
  680    HB2  LYS  86           HB3      LYS  86 -11.588 -11.667   3.008
  681    HB3  LYS  86           HB2      LYS  86 -10.239 -11.500   4.123
  682    HG2  LYS  86           HG3      LYS  86 -12.499 -10.195   5.252
  683    HG3  LYS  86           HG2      LYS  86 -12.984 -11.805   4.716
  684    HD2  LYS  86           HD3      LYS  86 -11.515 -12.868   6.143
  685    HD3  LYS  86           HD2      LYS  86 -10.439 -11.475   6.240
  686    HE2  LYS  86           HE3      LYS  86 -12.531 -10.358   7.377
  687    HE3  LYS  86           HE2      LYS  86 -12.970 -12.034   7.708
  688    HZ1  LYS  86           HZ1      LYS  86 -10.286 -10.998   8.376
  689    HZ2  LYS  86           HZ2      LYS  86 -11.085 -12.347   9.007
  690    HZ3  LYS  86           HZ3      LYS  86 -11.588 -10.790   9.437
  691    H    LYS  87           H        LYS  87 -13.353  -8.874   3.618
  692    HA   LYS  87           HA       LYS  87 -14.703  -9.471   1.395
  693    HB2  LYS  87           HB3      LYS  87 -15.001  -7.591   3.451
  694    HB3  LYS  87           HB2      LYS  87 -15.198  -6.682   1.960
  695    HG2  LYS  87           HG3      LYS  87 -17.289  -7.395   1.861
  696    HG3  LYS  87           HG2      LYS  87 -16.681  -9.036   1.629
  697    HD2  LYS  87           HD3      LYS  87 -16.500  -9.164   4.161
  698    HD3  LYS  87           HD2      LYS  87 -17.455  -7.681   4.201
  699    HE2  LYS  87           HE3      LYS  87 -18.784  -9.783   4.458
  700    HE3  LYS  87           HE2      LYS  87 -19.295  -8.748   3.125
  701    HZ1  LYS  87           HZ1      LYS  87 -19.022 -11.278   2.752
  702    HZ2  LYS  87           HZ2      LYS  87 -17.375 -10.918   2.624
  703    HZ3  LYS  87           HZ3      LYS  87 -18.481 -10.203   1.565
  704    H    LYS  88           H        LYS  88 -14.241  -9.336  -0.697
  705    HA   LYS  88           HA       LYS  88 -12.193  -7.925  -1.866
  706    HB2  LYS  88           HB3      LYS  88 -13.367  -9.720  -3.017
  707    HB3  LYS  88           HB2      LYS  88 -14.827  -8.742  -3.104
  708    HG2  LYS  88           HG3      LYS  88 -13.837  -7.242  -4.647
  709    HG3  LYS  88           HG2      LYS  88 -12.233  -7.936  -4.392
  710    HD2  LYS  88           HD3      LYS  88 -14.461  -8.874  -6.073
  711    HD3  LYS  88           HD2      LYS  88 -12.720  -9.076  -6.278
  712    HE2  LYS  88           HE3      LYS  88 -13.687 -11.234  -5.904
  713    HE3  LYS  88           HE2      LYS  88 -12.772 -10.782  -4.467
  714    HZ1  LYS  88           HZ1      LYS  88 -15.416 -11.564  -4.584
  715    HZ2  LYS  88           HZ2      LYS  88 -15.455  -9.907  -4.249
  716    HZ3  LYS  88           HZ3      LYS  88 -14.591 -10.953  -3.239
  717    H    THR  89           H        THR  89 -15.506  -6.892  -1.278
  718    HA   THR  89           HA       THR  89 -15.344  -4.464  -2.739
  719    HB   THR  89           HB       THR  89 -17.474  -4.020  -1.960
  720    HG1  THR  89           HG1      THR  89 -17.351  -3.801   0.161
  721   HG21  THR  89          HG21      THR  89 -17.362  -6.952  -1.329
  722   HG22  THR  89          HG22      THR  89 -17.419  -6.301  -2.968
  723   HG23  THR  89          HG23      THR  89 -18.756  -6.010  -1.855
  724    H    GLU  90           H        GLU  90 -14.480  -5.397   0.506
  725    HA   GLU  90           HA       GLU  90 -14.231  -2.735   1.527
  726    HB2  GLU  90           HB3      GLU  90 -12.990  -5.286   2.573
  727    HB3  GLU  90           HB2      GLU  90 -13.179  -3.779   3.459
  728    HG2  GLU  90           HG3      GLU  90 -15.652  -4.931   2.358
  729    HG3  GLU  90           HG2      GLU  90 -14.871  -5.859   3.637
  730    H    ARG  91           H        ARG  91 -11.969  -5.191   0.365
  731    HA   ARG  91           HA       ARG  91  -9.604  -3.717   0.722
  732    HB2  ARG  91           HB3      ARG  91 -10.131  -5.921  -1.222
  733    HB3  ARG  91           HB2      ARG  91  -8.586  -5.093  -1.076
  734    HG2  ARG  91           HG3      ARG  91  -9.046  -5.751   1.505
  735    HG3  ARG  91           HG2      ARG  91  -9.841  -7.100   0.670
  736    HD2  ARG  91           HD3      ARG  91  -7.199  -6.916  -0.601
  737    HD3  ARG  91           HD2      ARG  91  -7.091  -6.637   1.135
  738    HE   ARG  91           HE       ARG  91  -8.431  -8.770   1.140
  739   HH11  ARG  91          HH11      ARG  91  -6.025  -7.802  -1.184
  740   HH12  ARG  91          HH12      ARG  91  -5.508  -9.421  -1.517
  741   HH21  ARG  91          HH21      ARG  91  -7.759 -10.907   0.709
  742   HH22  ARG  91          HH22      ARG  91  -6.494 -11.188  -0.441
  743    H    GLU  92           H        GLU  92 -11.627  -4.161  -2.170
  744    HA   GLU  92           HA       GLU  92 -10.151  -2.525  -3.886
  745    HB2  GLU  92           HB3      GLU  92 -12.013  -4.118  -4.510
  746    HB3  GLU  92           HB2      GLU  92 -13.145  -2.884  -3.975
  747    HG2  GLU  92           HG3      GLU  92 -12.916  -2.777  -6.358
  748    HG3  GLU  92           HG2      GLU  92 -12.199  -1.334  -5.640
  749    H    ASP  93           H        ASP  93 -12.749  -1.751  -1.624
  750    HA   ASP  93           HA       ASP  93 -13.198   0.901  -2.393
  751    HB2  ASP  93           HB3      ASP  93 -14.757  -0.067  -0.897
  752    HB3  ASP  93           HB2      ASP  93 -13.500  -0.523   0.246
  753    H    GLY  94           H        GLY  94 -10.950  -0.441   0.012
  754    HA2  GLY  94           HA3      GLY  94  -9.879   1.986   0.912
  755    HA3  GLY  94           HA2      GLY  94  -9.051   0.435   0.957
  756    H    ILE  95           H        ILE  95  -9.082   0.002  -1.883
  757    HA   ILE  95           HA       ILE  95  -6.677   1.248  -2.596
  758    HB   ILE  95           HB       ILE  95  -8.669  -0.447  -3.975
  759   HG12  ILE  95          HG13      ILE  95  -5.670  -0.437  -3.654
  760   HG13  ILE  95          HG12      ILE  95  -6.831  -1.485  -2.842
  761   HG21  ILE  95          HG21      ILE  95  -8.532   0.596  -5.935
  762   HG22  ILE  95          HG22      ILE  95  -6.850   0.072  -5.989
  763   HG23  ILE  95          HG23      ILE  95  -7.255   1.670  -5.362
  764   HD11  ILE  95          HD11      ILE  95  -6.519  -1.495  -5.818
  765   HD12  ILE  95          HD12      ILE  95  -7.231  -2.723  -4.770
  766   HD13  ILE  95          HD13      ILE  95  -5.488  -2.461  -4.760
  767    H    ALA  96           H        ALA  96 -10.039   2.049  -3.355
  768    HA   ALA  96           HA       ALA  96  -9.588   4.020  -5.283
  769    HB1  ALA  96           HB1      ALA  96 -11.814   3.184  -4.839
  770    HB2  ALA  96           HB2      ALA  96 -11.787   4.932  -4.601
  771    HB3  ALA  96           HB3      ALA  96 -11.774   3.851  -3.207
  772    H    TYR  97           H        TYR  97  -9.832   4.283  -1.753
  773    HA   TYR  97           HA       TYR  97  -9.398   7.052  -1.569
  774    HB2  TYR  97           HB3      TYR  97 -10.216   5.949   0.369
  775    HB3  TYR  97           HB2      TYR  97  -8.902   4.780   0.354
  776    HD1  TYR  97           HD1      TYR  97  -7.946   5.087   2.477
  777    HD2  TYR  97           HD2      TYR  97  -8.648   8.470  -0.007
  778    HE1  TYR  97           HE1      TYR  97  -6.677   6.494   4.043
  779    HE2  TYR  97           HE2      TYR  97  -7.380   9.886   1.553
  780    HH   TYR  97           HH       TYR  97  -5.560   8.539   4.194
  781    H    LEU  98           H        LEU  98  -7.220   4.309  -1.753
  782    HA   LEU  98           HA       LEU  98  -4.807   5.642  -1.189
  783    HB2  LEU  98           HB3      LEU  98  -5.596   3.050  -1.829
  784    HB3  LEU  98           HB2      LEU  98  -4.542   3.513  -3.149
  785    HG   LEU  98           HG       LEU  98  -3.745   3.730  -0.250
  786   HD11  LEU  98          HD11      LEU  98  -2.290   1.672  -1.342
  787   HD12  LEU  98          HD12      LEU  98  -3.907   1.405  -1.999
  788   HD13  LEU  98          HD13      LEU  98  -3.668   1.498  -0.255
  789   HD21  LEU  98          HD21      LEU  98  -2.256   3.925  -2.859
  790   HD22  LEU  98          HD22      LEU  98  -1.457   3.713  -1.301
  791   HD23  LEU  98          HD23      LEU  98  -2.424   5.157  -1.608
  792    H    LYS  99           H        LYS  99  -6.675   5.259  -4.136
  793    HA   LYS  99           HA       LYS  99  -4.771   6.088  -6.002
  794    HB2  LYS  99           HB3      LYS  99  -7.723   6.699  -6.165
  795    HB3  LYS  99           HB2      LYS  99  -6.595   6.478  -7.497
  796    HG2  LYS  99           HG3      LYS  99  -7.543   4.358  -5.582
  797    HG3  LYS  99           HG2      LYS  99  -8.003   4.537  -7.276
  798    HD2  LYS  99           HD3      LYS  99  -6.312   2.866  -6.608
  799    HD3  LYS  99           HD2      LYS  99  -5.381   4.414  -7.619
  800    HE2  LYS  99           HE3      LYS  99  -4.182   3.689  -5.897
  801    HE3  LYS  99           HE2      LYS  99  -5.611   3.854  -4.879
  802    HZ1  LYS  99           HZ1      LYS  99  -4.289   1.512  -5.606
  803    HZ2  LYS  99           HZ2      LYS  99  -5.808   1.469  -6.346
  804    HZ3  LYS  99           HZ3      LYS  99  -5.691   1.667  -4.672
  805    H    LYS 100           H        LYS 100  -7.085   7.977  -4.088
  806    HA   LYS 100           HA       LYS 100  -6.236  10.477  -5.216
  807    HB2  LYS 100           HB3      LYS 100  -8.289  10.946  -4.434
  808    HB3  LYS 100           HB2      LYS 100  -8.277   9.549  -3.369
  809    HG2  LYS 100           HG3      LYS 100  -6.936  10.858  -1.748
  810    HG3  LYS 100           HG2      LYS 100  -7.114  12.265  -2.797
  811    HD2  LYS 100           HD3      LYS 100  -9.282  10.755  -1.350
  812    HD3  LYS 100           HD2      LYS 100  -8.780  12.429  -1.102
  813    HE2  LYS 100           HE3      LYS 100  -9.877  11.447  -3.723
  814    HE3  LYS 100           HE2      LYS 100 -10.918  12.042  -2.430
  815    HZ1  LYS 100           HZ1      LYS 100  -9.484  13.520  -4.332
  816    HZ2  LYS 100           HZ2      LYS 100  -8.868  13.899  -2.803
  817    HZ3  LYS 100           HZ3      LYS 100 -10.519  14.090  -3.121
  818    H    ALA 101           H        ALA 101  -5.580   8.620  -2.343
  819    HA   ALA 101           HA       ALA 101  -4.184  10.464  -0.799
  820    HB1  ALA 101           HB1      ALA 101  -3.426   7.570  -0.834
  821    HB2  ALA 101           HB2      ALA 101  -5.005   8.078  -0.233
  822    HB3  ALA 101           HB3      ALA 101  -3.534   8.681   0.531
  823    H    THR 102           H        THR 102  -3.225   8.685  -3.603
  824    HA   THR 102           HA       THR 102  -0.443   9.558  -3.238
  825    HB   THR 102           HB       THR 102  -0.391   7.286  -3.829
  826    HG1  THR 102           HG1      THR 102  -0.877   7.989  -5.499
  827   HG21  THR 102          HG21      THR 102  -2.890   7.854  -5.206
  828   HG22  THR 102          HG22      THR 102  -2.307   6.361  -4.471
  829   HG23  THR 102          HG23      THR 102  -1.811   6.790  -6.108
  830    H    ASN 103           H        ASN 103  -3.380  10.050  -4.873
  831    HA   ASN 103           HA       ASN 103  -2.373  12.450  -6.067
  832    HB2  ASN 103           HB3      ASN 103  -3.778  10.746  -8.056
  833    HB3  ASN 103           HB2      ASN 103  -2.532  11.967  -8.301
  834   HD21  ASN 103          HD21      ASN 103  -3.136   8.665  -7.295
  835   HD22  ASN 103          HD22      ASN 103  -1.543   8.077  -7.610
  836    H    GLU 104           H        GLU 104  -3.847  13.784  -5.306
  837    HA   GLU 104           HA       GLU 104  -6.276  14.331  -6.182
  838    HB2  GLU 104           HB3      GLU 104  -6.443  11.967  -4.385
  839    HB3  GLU 104           HB2      GLU 104  -7.721  13.167  -4.288
  840    HG2  GLU 104           HG3      GLU 104  -7.080  12.398  -7.020
  841    HG3  GLU 104           HG2      GLU 104  -7.631  11.052  -6.026
  842    HHA  HEC 201           HHA      HEC 201   5.261  -5.238   0.496
  843    HHB  HEC 201           HHB      HEC 201  -0.298  -2.485   0.351
  844    HHC  HEC 201           HHC      HEC 201  -1.980  -6.213   5.160
  845    HHD  HEC 201           HHD      HEC 201   4.141  -6.040   6.791
  846   HMA1  HEC 201          HMA1      HEC 201   1.063  -1.174  -1.187
  847   HMA2  HEC 201          HMA2      HEC 201   2.673  -0.360  -0.651
  848   HMA3  HEC 201          HMA3      HEC 201   2.473  -1.612  -1.495
  849   HAA1  HEC 201          HAA1      HEC 201   5.130  -3.074  -1.373
  850   HAA2  HEC 201          HAA2      HEC 201   5.716  -2.471   0.185
  851   HBA1  HEC 201          HBA1      HEC 201   4.264  -0.410  -0.195
  852   HBA2  HEC 201          HBA2      HEC 201   4.000  -1.008  -1.846
  853   HMB1  HEC 201          HMB1      HEC 201  -3.477  -1.978   2.043
  854   HMB2  HEC 201          HMB2      HEC 201  -3.566  -3.238   0.796
  855   HMB3  HEC 201          HMB3      HEC 201  -2.289  -1.994   0.716
  856    HAB  HEC 201           HAB      HEC 201  -3.807  -3.350   4.522
  857   HBB1  HEC 201          HBB1      HEC 201  -5.253  -5.281   2.711
  858   HBB2  HEC 201          HBB2      HEC 201  -4.605  -3.787   2.001
  859   HBB3  HEC 201          HBB3      HEC 201  -5.719  -3.701   3.394
  860   HMC1  HEC 201          HMC1      HEC 201  -0.872  -7.743   8.479
  861   HMC2  HEC 201          HMC2      HEC 201  -1.855  -7.845   6.877
  862   HMC3  HEC 201          HMC3      HEC 201  -0.515  -8.483   7.213
  863    HAC  HEC 201           HAC      HEC 201   3.056  -7.054   8.240
  864   HBC1  HEC 201          HBC1      HEC 201   3.329  -9.442   7.683
  865   HBC2  HEC 201          HBC2      HEC 201   1.677  -9.751   8.255
  866   HBC3  HEC 201          HBC3      HEC 201   2.930  -9.201   9.402
  867   HMD1  HEC 201          HMD1      HEC 201   6.059  -7.248   6.376
  868   HMD2  HEC 201          HMD2      HEC 201   7.217  -5.955   6.002
  869   HMD3  HEC 201          HMD3      HEC 201   7.302  -7.509   5.127
  870   HAD1  HEC 201          HAD1      HEC 201   8.023  -6.492   3.170
  871   HAD2  HEC 201          HAD2      HEC 201   7.635  -5.047   2.221
  872   HBD1  HEC 201          HBD1      HEC 201   7.928  -7.699   1.291
  873   HBD2  HEC 201          HBD2      HEC 201   7.405  -6.275   0.369
  Start of MODEL    5
    1    H1   GLY   1          1H        GLY   1 -19.203   4.166  -0.476
    2    H2   GLY   1          2H        GLY   1 -18.582   3.660  -1.965
    3    H3   GLY   1          3H        GLY   1 -18.746   5.310  -1.637
    4    HA2  GLY   1           HA2      GLY   1 -17.142   3.900   0.295
    5    HA3  GLY   1           HA3      GLY   1 -16.473   3.884  -1.330
    6    H    ASP   2           H        ASP   2 -16.381   5.403   1.542
    7    HA   ASP   2           HA       ASP   2 -15.772   7.976   0.242
    8    HB2  ASP   2           HB3      ASP   2 -16.418   7.610   3.220
    9    HB3  ASP   2           HB2      ASP   2 -16.436   9.114   2.208
   10    H    VAL   3           H        VAL   3 -14.004   9.219   1.152
   11    HA   VAL   3           HA       VAL   3 -11.659   7.701   1.471
   12    HB   VAL   3           HB       VAL   3 -12.336  10.588   1.644
   13   HG11  VAL   3          HG11      VAL   3 -11.026  10.621   3.559
   14   HG12  VAL   3          HG12      VAL   3  -9.856  10.953   2.282
   15   HG13  VAL   3          HG13      VAL   3  -9.967   9.336   2.978
   16   HG21  VAL   3          HG21      VAL   3 -11.562  10.339  -0.435
   17   HG22  VAL   3          HG22      VAL   3 -10.851   8.766  -0.069
   18   HG23  VAL   3          HG23      VAL   3  -9.957  10.243   0.292
   19    H    GLU   4           H        GLU   4 -13.709   9.389   3.812
   20    HA   GLU   4           HA       GLU   4 -12.101   9.048   6.123
   21    HB2  GLU   4           HB3      GLU   4 -14.013  10.526   6.160
   22    HB3  GLU   4           HB2      GLU   4 -15.110   9.182   5.878
   23    HG2  GLU   4           HG3      GLU   4 -14.246   8.236   8.081
   24    HG3  GLU   4           HG2      GLU   4 -13.550   9.832   8.354
   25    H    LYS   5           H        LYS   5 -14.640   6.941   4.814
   26    HA   LYS   5           HA       LYS   5 -14.496   4.987   6.844
   27    HB2  LYS   5           HB3      LYS   5 -15.337   4.605   3.965
   28    HB3  LYS   5           HB2      LYS   5 -15.739   3.598   5.337
   29    HG2  LYS   5           HG3      LYS   5 -16.650   6.009   6.159
   30    HG3  LYS   5           HG2      LYS   5 -16.981   6.040   4.425
   31    HD2  LYS   5           HD3      LYS   5 -17.680   3.522   5.759
   32    HD3  LYS   5           HD2      LYS   5 -18.608   4.922   6.300
   33    HE2  LYS   5           HE3      LYS   5 -19.861   4.795   4.474
   34    HE3  LYS   5           HE2      LYS   5 -18.430   5.044   3.476
   35    HZ1  LYS   5           HZ1      LYS   5 -19.971   2.712   3.779
   36    HZ2  LYS   5           HZ2      LYS   5 -18.401   2.394   4.321
   37    HZ3  LYS   5           HZ3      LYS   5 -18.651   2.980   2.754
   38    H    GLY   6           H        GLY   6 -12.790   5.394   3.787
   39    HA2  GLY   6           HA3      GLY   6 -11.535   2.873   3.699
   40    HA3  GLY   6           HA2      GLY   6 -10.955   4.332   2.913
   41    H    LYS   7           H        LYS   7 -10.489   5.917   5.096
   42    HA   LYS   7           HA       LYS   7  -7.908   5.172   5.766
   43    HB2  LYS   7           HB3      LYS   7  -8.306   7.439   6.017
   44    HB3  LYS   7           HB2      LYS   7  -9.833   7.183   6.854
   45    HG2  LYS   7           HG3      LYS   7  -7.698   6.094   8.415
   46    HG3  LYS   7           HG2      LYS   7  -7.322   7.761   7.970
   47    HD2  LYS   7           HD3      LYS   7 -10.006   7.825   8.682
   48    HD3  LYS   7           HD2      LYS   7  -9.268   6.740   9.861
   49    HE2  LYS   7           HE3      LYS   7  -8.761   8.638  10.950
   50    HE3  LYS   7           HE2      LYS   7  -7.441   8.740   9.785
   51    HZ1  LYS   7           HZ1      LYS   7  -8.351  10.771   9.472
   52    HZ2  LYS   7           HZ2      LYS   7  -9.903  10.293   9.942
   53    HZ3  LYS   7           HZ3      LYS   7  -9.337   9.918   8.393
   54    H    LYS   8           H        LYS   8 -10.938   4.891   7.669
   55    HA   LYS   8           HA       LYS   8  -9.782   3.829  10.014
   56    HB2  LYS   8           HB3      LYS   8 -11.913   4.628  10.385
   57    HB3  LYS   8           HB2      LYS   8 -12.539   3.965   8.881
   58    HG2  LYS   8           HG3      LYS   8 -11.680   2.103  11.042
   59    HG3  LYS   8           HG2      LYS   8 -13.228   2.939  11.177
   60    HD2  LYS   8           HD3      LYS   8 -12.359   1.241   8.840
   61    HD3  LYS   8           HD2      LYS   8 -13.451   0.724  10.125
   62    HE2  LYS   8           HE3      LYS   8 -13.935   3.037   8.250
   63    HE3  LYS   8           HE2      LYS   8 -14.648   1.432   8.089
   64    HZ1  LYS   8           HZ1      LYS   8 -15.223   3.532  10.057
   65    HZ2  LYS   8           HZ2      LYS   8 -15.432   1.917  10.513
   66    HZ3  LYS   8           HZ3      LYS   8 -16.292   2.540   9.196
   67    H    ILE   9           H        ILE   9 -11.114   2.314   7.116
   68    HA   ILE   9           HA       ILE   9 -11.047  -0.348   8.004
   69    HB   ILE   9           HB       ILE   9 -11.167   0.983   5.358
   70   HG12  ILE   9          HG13      ILE   9 -12.681  -1.323   6.608
   71   HG13  ILE   9          HG12      ILE   9 -13.187   0.364   6.631
   72   HG21  ILE   9          HG21      ILE   9  -9.724  -0.483   4.449
   73   HG22  ILE   9          HG22      ILE   9 -11.091  -1.592   4.540
   74   HG23  ILE   9          HG23      ILE   9  -9.855  -1.612   5.798
   75   HD11  ILE   9          HD11      ILE   9 -13.543  -1.644   4.595
   76   HD12  ILE   9          HD12      ILE   9 -12.774  -0.194   3.950
   77   HD13  ILE   9          HD13      ILE   9 -14.323  -0.073   4.783
   78    H    PHE  10           H        PHE  10  -8.641   1.587   6.261
   79    HA   PHE  10           HA       PHE  10  -6.697  -0.450   6.018
   80    HB2  PHE  10           HB3      PHE  10  -6.320   1.314   4.569
   81    HB3  PHE  10           HB2      PHE  10  -6.685   2.533   5.786
   82    HD1  PHE  10           HD1      PHE  10  -4.119   0.764   4.076
   83    HD2  PHE  10           HD2      PHE  10  -5.003   2.830   7.691
   84    HE1  PHE  10           HE1      PHE  10  -1.712   1.071   4.486
   85    HE2  PHE  10           HE2      PHE  10  -2.598   3.141   8.107
   86    HZ   PHE  10           HZ       PHE  10  -0.949   2.261   6.502
   87    H    VAL  11           H        VAL  11  -7.397   2.007   8.342
   88    HA   VAL  11           HA       VAL  11  -4.925   2.000   9.539
   89    HB   VAL  11           HB       VAL  11  -7.622   2.510  10.784
   90   HG11  VAL  11          HG11      VAL  11  -6.607   3.357  12.705
   91   HG12  VAL  11          HG12      VAL  11  -5.015   3.422  11.951
   92   HG13  VAL  11          HG13      VAL  11  -5.719   1.866  12.387
   93   HG21  VAL  11          HG21      VAL  11  -7.511   4.432   9.680
   94   HG22  VAL  11          HG22      VAL  11  -5.933   3.994   9.022
   95   HG23  VAL  11          HG23      VAL  11  -6.040   4.834  10.569
   96    H    GLN  12           H        GLN  12  -7.757   0.021  10.540
   97    HA   GLN  12           HA       GLN  12  -6.086  -1.421  12.513
   98    HB2  GLN  12           HB3      GLN  12  -8.228  -2.803  12.817
   99    HB3  GLN  12           HB2      GLN  12  -8.315  -1.103  13.257
  100    HG2  GLN  12           HG3      GLN  12 -10.122  -0.982  11.984
  101    HG3  GLN  12           HG2      GLN  12  -9.050  -1.137  10.593
  102   HE21  GLN  12          HE21      GLN  12  -8.309  -3.870  11.255
  103   HE22  GLN  12          HE22      GLN  12  -9.665  -4.855  10.839
  104    H    LYS  13           H        LYS  13  -7.818  -1.954   9.696
  105    HA   LYS  13           HA       LYS  13  -7.679  -4.202   8.524
  106    HB2  LYS  13           HB3      LYS  13  -8.016  -2.486   7.106
  107    HB3  LYS  13           HB2      LYS  13  -6.697  -1.564   7.592
  108    HG2  LYS  13           HG3      LYS  13  -6.199  -2.256   5.434
  109    HG3  LYS  13           HG2      LYS  13  -5.348  -3.418   6.456
  110    HD2  LYS  13           HD3      LYS  13  -6.482  -5.104   5.555
  111    HD3  LYS  13           HD2      LYS  13  -8.018  -4.337   5.966
  112    HE2  LYS  13           HE3      LYS  13  -7.159  -2.860   3.818
  113    HE3  LYS  13           HE2      LYS  13  -6.815  -4.688   3.429
  114    HZ1  LYS  13           HZ1      LYS  13  -9.381  -3.972   4.316
  115    HZ2  LYS  13           HZ2      LYS  13  -8.782  -5.302   3.461
  116    HZ3  LYS  13           HZ3      LYS  13  -8.942  -3.807   2.690
  117    H    CYS  14           H        CYS  14  -4.641  -2.240   8.927
  118    HA   CYS  14           HA       CYS  14  -2.985  -4.370   9.577
  119    HB2  CYS  14           HB3      CYS  14  -1.603  -4.800   7.672
  120    HB3  CYS  14           HB2      CYS  14  -3.274  -5.466   7.518
  121    H    ALA  15           H        ALA  15  -3.585  -1.287   9.492
  122    HA   ALA  15           HA       ALA  15  -1.368   0.099   8.592
  123    HB1  ALA  15           HB1      ALA  15  -2.774   0.833  11.139
  124    HB2  ALA  15           HB2      ALA  15  -3.552   0.998   9.566
  125    HB3  ALA  15           HB3      ALA  15  -2.075   1.894   9.916
  126    H    GLN  16           H        GLN  16  -1.518  -2.099  11.549
  127    HA   GLN  16           HA       GLN  16   0.703  -1.135  12.898
  128    HB2  GLN  16           HB3      GLN  16   0.396  -4.072  12.902
  129    HB3  GLN  16           HB2      GLN  16   0.460  -2.943  14.250
  130    HG2  GLN  16           HG3      GLN  16  -1.895  -2.255  13.572
  131    HG3  GLN  16           HG2      GLN  16  -1.896  -3.698  12.558
  132   HE21  GLN  16          HE21      GLN  16  -0.749  -2.956  15.837
  133   HE22  GLN  16          HE22      GLN  16  -1.583  -4.258  16.607
  134    H    CYS  17           H        CYS  17   0.502  -3.330  10.164
  135    HA   CYS  17           HA       CYS  17   3.295  -3.995  10.188
  136    HB2  CYS  17           HB3      CYS  17   1.472  -4.302   7.815
  137    HB3  CYS  17           HB2      CYS  17   2.858  -5.288   8.270
  138    H    HIS  18           H        HIS  18   1.391  -1.417   8.975
  139    HA   HIS  18           HA       HIS  18   3.618  -0.509   7.281
  140    HB2  HIS  18           HB3      HIS  18   0.720   0.345   7.177
  141    HB3  HIS  18           HB2      HIS  18   1.995   0.857   6.076
  142    HD1  HIS  18           HD1      HIS  18   1.727  -0.286   3.911
  143    HD2  HIS  18           HD2      HIS  18   0.740  -2.770   7.089
  144    HE1  HIS  18           HE1      HIS  18   1.119  -2.494   2.873
  145    H    THR  19           H        THR  19   3.096  -0.218  10.263
  146    HA   THR  19           HA       THR  19   3.262   1.358  11.897
  147    HB   THR  19           HB       THR  19   4.745   2.876   9.744
  148    HG1  THR  19           HG1      THR  19   6.555   1.778  10.509
  149   HG21  THR  19          HG21      THR  19   5.170   2.953  12.716
  150   HG22  THR  19          HG22      THR  19   4.264   4.167  11.811
  151   HG23  THR  19          HG23      THR  19   5.980   3.923  11.485
  152    H    VAL  20           H        VAL  20   2.640   3.493  12.627
  153    HA   VAL  20           HA       VAL  20   0.246   4.393  11.276
  154    HB   VAL  20           HB       VAL  20   1.344   5.683  13.747
  155   HG11  VAL  20          HG11      VAL  20  -0.782   6.371  12.409
  156   HG12  VAL  20          HG12      VAL  20  -0.844   6.296  14.170
  157   HG13  VAL  20          HG13      VAL  20  -1.509   4.976  13.208
  158   HG21  VAL  20          HG21      VAL  20   0.314   3.978  15.125
  159   HG22  VAL  20          HG22      VAL  20   1.524   3.244  14.071
  160   HG23  VAL  20          HG23      VAL  20  -0.191   3.087  13.689
  161    H    GLU  21           H        GLU  21   0.796   7.101  12.645
  162    HA   GLU  21           HA       GLU  21   1.533   8.491  10.301
  163    HB2  GLU  21           HB3      GLU  21   1.890  10.056  12.716
  164    HB3  GLU  21           HB2      GLU  21   0.737  10.265  11.406
  165    HG2  GLU  21           HG3      GLU  21  -0.728   8.598  12.433
  166    HG3  GLU  21           HG2      GLU  21   0.428   8.402  13.751
  167    H    LYS  22           H        LYS  22   3.388   9.616   9.764
  168    HA   LYS  22           HA       LYS  22   5.832   8.453  10.297
  169    HB2  LYS  22           HB3      LYS  22   5.166  10.134   8.458
  170    HB3  LYS  22           HB2      LYS  22   5.584  11.375   9.630
  171    HG2  LYS  22           HG3      LYS  22   7.395   9.284   8.452
  172    HG3  LYS  22           HG2      LYS  22   7.467  11.032   8.221
  173    HD2  LYS  22           HD3      LYS  22   7.956   9.544  10.799
  174    HD3  LYS  22           HD2      LYS  22   9.179  10.319   9.789
  175    HE2  LYS  22           HE3      LYS  22   8.251  12.488  10.234
  176    HE3  LYS  22           HE2      LYS  22   6.880  11.776  11.082
  177    HZ1  LYS  22           HZ1      LYS  22   9.367  12.519  12.127
  178    HZ2  LYS  22           HZ2      LYS  22   9.226  10.840  12.278
  179    HZ3  LYS  22           HZ3      LYS  22   8.046  11.850  12.944
  180    H    GLY  23           H        GLY  23   7.049   8.382  12.037
  181    HA2  GLY  23           HA3      GLY  23   8.197  10.215  13.546
  182    HA3  GLY  23           HA2      GLY  23   6.569  10.275  14.211
  183    H    GLY  24           H        GLY  24   6.099   7.419  13.806
  184    HA2  GLY  24           HA3      GLY  24   7.256   6.503  16.280
  185    HA3  GLY  24           HA2      GLY  24   6.152   5.606  15.247
  186    H    LYS  25           H        LYS  25   7.080   3.724  14.767
  187    HA   LYS  25           HA       LYS  25   9.939   3.714  14.063
  188    HB2  LYS  25           HB3      LYS  25   8.760   1.091  14.490
  189    HB3  LYS  25           HB2      LYS  25  10.183   1.814  15.226
  190    HG2  LYS  25           HG3      LYS  25   9.043   2.548  17.048
  191    HG3  LYS  25           HG2      LYS  25   7.538   2.770  16.155
  192    HD2  LYS  25           HD3      LYS  25   8.732   0.140  17.030
  193    HD3  LYS  25           HD2      LYS  25   7.320   0.934  17.731
  194    HE2  LYS  25           HE3      LYS  25   6.002  -0.021  16.221
  195    HE3  LYS  25           HE2      LYS  25   6.941   0.701  14.913
  196    HZ1  LYS  25           HZ1      LYS  25   6.956  -2.000  15.904
  197    HZ2  LYS  25           HZ2      LYS  25   8.505  -1.351  15.714
  198    HZ3  LYS  25           HZ3      LYS  25   7.443  -1.398  14.401
  199    H    HIS  26           H        HIS  26  10.621   2.323  12.314
  200    HA   HIS  26           HA       HIS  26   9.047   2.620  10.000
  201    HB2  HIS  26           HB3      HIS  26  10.942   0.520   9.604
  202    HB3  HIS  26           HB2      HIS  26  11.006   2.180   9.021
  203    HD1  HIS  26           HD1      HIS  26  11.696   0.465  12.360
  204    HD2  HIS  26           HD2      HIS  26  13.266   3.381   9.850
  205    HE1  HIS  26           HE1      HIS  26  13.790   1.271  13.494
  206    HE2  HIS  26           HE2      HIS  26  14.672   3.101  12.002
  207    H    LYS  27           H        LYS  27   7.776   1.226   8.857
  208    HA   LYS  27           HA       LYS  27   6.686  -1.010  10.348
  209    HB2  LYS  27           HB3      LYS  27   4.842  -0.871   8.976
  210    HB3  LYS  27           HB2      LYS  27   5.415   0.791   8.918
  211    HG2  LYS  27           HG3      LYS  27   6.772  -0.464   6.855
  212    HG3  LYS  27           HG2      LYS  27   5.147  -1.151   6.795
  213    HD2  LYS  27           HD3      LYS  27   5.617   1.005   5.466
  214    HD3  LYS  27           HD2      LYS  27   4.149   0.924   6.444
  215    HE2  LYS  27           HE3      LYS  27   4.809   2.625   7.723
  216    HE3  LYS  27           HE2      LYS  27   6.400   1.908   7.973
  217    HZ1  LYS  27           HZ1      LYS  27   7.207   2.901   6.007
  218    HZ2  LYS  27           HZ2      LYS  27   6.373   4.120   6.832
  219    HZ3  LYS  27           HZ3      LYS  27   5.659   3.361   5.499
  220    H    THR  28           H        THR  28   6.077  -2.994   8.939
  221    HA   THR  28           HA       THR  28   8.503  -4.225   8.128
  222    HB   THR  28           HB       THR  28   5.883  -5.398   7.331
  223    HG1  THR  28           HG1      THR  28   6.682  -5.464  10.029
  224   HG21  THR  28          HG21      THR  28   6.812  -7.431   7.897
  225   HG22  THR  28          HG22      THR  28   7.993  -6.707   8.988
  226   HG23  THR  28          HG23      THR  28   8.189  -6.545   7.243
  227    H    GLY  29           H        GLY  29   5.760  -2.853   6.380
  228    HA2  GLY  29           HA3      GLY  29   7.387  -2.965   3.927
  229    HA3  GLY  29           HA2      GLY  29   5.717  -3.509   3.895
  230    HA   PRO  30           HA       PRO  30   6.611   1.301   3.203
  231    HB2  PRO  30           HB3      PRO  30   5.557   0.345   0.568
  232    HB3  PRO  30           HB2      PRO  30   6.681   1.665   0.915
  233    HG2  PRO  30           HG3      PRO  30   7.573  -0.681   0.017
  234    HG3  PRO  30           HG2      PRO  30   8.474   0.234   1.239
  235    HD2  PRO  30           HD3      PRO  30   6.867  -2.243   1.533
  236    HD3  PRO  30           HD2      PRO  30   8.258  -1.677   2.480
  237    H    ASN  31           H        ASN  31   4.961   2.336   4.116
  238    HA   ASN  31           HA       ASN  31   2.396   1.358   4.476
  239    HB2  ASN  31           HB3      ASN  31   3.695   3.452   5.483
  240    HB3  ASN  31           HB2      ASN  31   2.753   4.310   4.269
  241   HD21  ASN  31          HD21      ASN  31   2.066   5.212   6.485
  242   HD22  ASN  31          HD22      ASN  31   0.652   4.493   7.169
  243    H    LEU  32           H        LEU  32   3.317   3.972   2.224
  244    HA   LEU  32           HA       LEU  32   1.840   2.923   0.162
  245    HB2  LEU  32           HB3      LEU  32  -0.057   4.432  -0.101
  246    HB3  LEU  32           HB2      LEU  32  -0.093   3.472   1.368
  247    HG   LEU  32           HG       LEU  32  -1.143   5.601   1.931
  248   HD11  LEU  32          HD11      LEU  32   1.521   5.229   2.872
  249   HD12  LEU  32          HD12      LEU  32   0.094   4.548   3.651
  250   HD13  LEU  32          HD13      LEU  32   0.361   6.290   3.672
  251   HD21  LEU  32          HD21      LEU  32  -0.370   7.563   1.169
  252   HD22  LEU  32          HD22      LEU  32   0.300   6.487  -0.057
  253   HD23  LEU  32          HD23      LEU  32   1.291   7.005   1.313
  254    H    HIS  33           H        HIS  33   3.341   5.629   1.702
  255    HA   HIS  33           HA       HIS  33   3.445   7.587  -0.219
  256    HB2  HIS  33           HB3      HIS  33   4.738   7.083   2.206
  257    HB3  HIS  33           HB2      HIS  33   6.042   7.273   1.040
  258    HD1  HIS  33           HD1      HIS  33   6.687   9.519   2.222
  259    HD2  HIS  33           HD2      HIS  33   2.916   9.485   0.475
  260    HE1  HIS  33           HE1      HIS  33   5.968  11.926   2.127
  261    HE2  HIS  33           HE2      HIS  33   3.649  11.873   1.146
  262    H    GLY  34           H        GLY  34   4.202   7.697  -2.225
  263    HA2  GLY  34           HA3      GLY  34   5.522   7.322  -4.075
  264    HA3  GLY  34           HA2      GLY  34   6.675   6.518  -3.021
  265    H    LEU  35           H        LEU  35   3.481   5.325  -2.855
  266    HA   LEU  35           HA       LEU  35   4.194   2.735  -3.651
  267    HB2  LEU  35           HB3      LEU  35   2.259   3.323  -2.203
  268    HB3  LEU  35           HB2      LEU  35   1.431   3.949  -3.617
  269    HG   LEU  35           HG       LEU  35   1.358   1.737  -4.612
  270   HD11  LEU  35          HD11      LEU  35   2.505  -0.070  -3.891
  271   HD12  LEU  35          HD12      LEU  35   2.366   0.383  -2.191
  272   HD13  LEU  35          HD13      LEU  35   3.573   1.161  -3.215
  273   HD21  LEU  35          HD21      LEU  35   0.351   2.059  -1.813
  274   HD22  LEU  35          HD22      LEU  35   0.063   0.566  -2.704
  275   HD23  LEU  35          HD23      LEU  35  -0.541   2.097  -3.333
  276    H    PHE  36           H        PHE  36   2.416   5.271  -5.393
  277    HA   PHE  36           HA       PHE  36   2.788   3.731  -7.872
  278    HB2  PHE  36           HB3      PHE  36   0.923   6.048  -7.786
  279    HB3  PHE  36           HB2      PHE  36   0.791   4.531  -8.670
  280    HD1  PHE  36           HD1      PHE  36  -0.270   2.620  -7.701
  281    HD2  PHE  36           HD2      PHE  36   0.271   6.179  -5.432
  282    HE1  PHE  36           HE1      PHE  36  -1.825   1.766  -5.997
  283    HE2  PHE  36           HE2      PHE  36  -1.284   5.331  -3.725
  284    HZ   PHE  36           HZ       PHE  36  -2.335   3.121  -4.007
  285    H    GLY  37           H        GLY  37   4.522   5.799  -6.341
  286    HA2  GLY  37           HA3      GLY  37   5.073   7.477  -8.711
  287    HA3  GLY  37           HA2      GLY  37   5.188   8.102  -7.073
  288    H    ARG  38           H        ARG  38   6.439   5.840  -5.896
  289    HA   ARG  38           HA       ARG  38   9.147   6.284  -6.857
  290    HB2  ARG  38           HB3      ARG  38   8.057   4.886  -4.412
  291    HB3  ARG  38           HB2      ARG  38   9.771   4.983  -4.796
  292    HG2  ARG  38           HG3      ARG  38   9.455   7.509  -4.831
  293    HG3  ARG  38           HG2      ARG  38   7.897   7.205  -4.061
  294    HD2  ARG  38           HD3      ARG  38   8.869   6.929  -2.081
  295    HD3  ARG  38           HD2      ARG  38   9.956   5.707  -2.737
  296    HE   ARG  38           HE       ARG  38  11.569   7.285  -2.449
  297   HH11  ARG  38          HH11      ARG  38   8.655   8.877  -3.494
  298   HH12  ARG  38          HH12      ARG  38   9.390  10.443  -3.590
  299   HH21  ARG  38          HH21      ARG  38  12.547   9.341  -2.569
  300   HH22  ARG  38          HH22      ARG  38  11.603  10.707  -3.063
  301    H    LYS  39           H        LYS  39  10.649   4.327  -6.848
  302    HA   LYS  39           HA       LYS  39   9.897   2.571  -8.850
  303    HB2  LYS  39           HB3      LYS  39  12.241   3.016  -8.230
  304    HB3  LYS  39           HB2      LYS  39  12.012   2.111  -6.741
  305    HG2  LYS  39           HG3      LYS  39  12.996   1.087  -9.064
  306    HG3  LYS  39           HG2      LYS  39  12.282   0.136  -7.761
  307    HD2  LYS  39           HD3      LYS  39  11.321  -0.472  -9.921
  308    HD3  LYS  39           HD2      LYS  39  10.102   0.257  -8.874
  309    HE2  LYS  39           HE3      LYS  39  10.702   2.452 -10.050
  310    HE3  LYS  39           HE2      LYS  39  11.483   1.436 -11.258
  311    HZ1  LYS  39           HZ1      LYS  39   9.510   0.662 -12.014
  312    HZ2  LYS  39           HZ2      LYS  39   8.958   2.152 -11.434
  313    HZ3  LYS  39           HZ3      LYS  39   8.747   0.753 -10.506
  314    H    THR  40           H        THR  40  10.991   0.915  -5.994
  315    HA   THR  40           HA       THR  40   8.420   0.004  -5.220
  316    HB   THR  40           HB       THR  40   8.919  -2.264  -4.969
  317    HG1  THR  40           HG1      THR  40  10.399  -3.459  -5.873
  318   HG21  THR  40          HG21      THR  40   8.597  -2.022  -7.720
  319   HG22  THR  40          HG22      THR  40   8.883  -2.859  -6.509
  320   HG23  THR  40          HG23      THR  40   7.492  -2.877  -6.206
  321    H    GLY  41           H        GLY  41   8.319   0.409  -3.426
  322    HA2  GLY  41           HA3      GLY  41   8.801   0.423  -1.181
  323    HA3  GLY  41           HA2      GLY  41   9.455  -1.182  -1.461
  324    H    GLN  42           H        GLN  42  10.692   1.841  -2.808
  325    HA   GLN  42           HA       GLN  42  13.241   1.290  -1.465
  326    HB2  GLN  42           HB3      GLN  42  13.752   3.342  -3.210
  327    HB3  GLN  42           HB2      GLN  42  13.995   1.634  -3.551
  328    HG2  GLN  42           HG3      GLN  42  12.773   2.827  -5.326
  329    HG3  GLN  42           HG2      GLN  42  11.864   1.484  -4.634
  330   HE21  GLN  42          HE21      GLN  42   9.802   2.002  -4.651
  331   HE22  GLN  42          HE22      GLN  42   9.124   3.506  -4.140
  332    H    ALA  43           H        ALA  43  11.307   2.334   0.187
  333    HA   ALA  43           HA       ALA  43  11.116   5.089   0.413
  334    HB1  ALA  43           HB1      ALA  43  11.208   4.227   3.033
  335    HB2  ALA  43           HB2      ALA  43  10.675   2.800   2.143
  336    HB3  ALA  43           HB3      ALA  43   9.773   4.311   2.011
  337    HA   PRO  44           HA       PRO  44  14.960   6.547   2.011
  338    HB2  PRO  44           HB3      PRO  44  14.332   8.203   4.021
  339    HB3  PRO  44           HB2      PRO  44  13.836   8.541   2.358
  340    HG2  PRO  44           HG3      PRO  44  12.242   7.380   4.609
  341    HG3  PRO  44           HG2      PRO  44  11.766   8.599   3.413
  342    HD2  PRO  44           HD3      PRO  44  11.111   5.936   3.241
  343    HD3  PRO  44           HD2      PRO  44  11.237   7.020   1.841
  344    H    GLY  45           H        GLY  45  14.044   7.083   5.228
  345    HA2  GLY  45           HA3      GLY  45  16.058   5.341   6.239
  346    HA3  GLY  45           HA2      GLY  45  14.921   6.276   7.198
  347    H    PHE  46           H        PHE  46  13.234   4.463   4.982
  348    HA   PHE  46           HA       PHE  46  12.300   2.660   7.031
  349    HB2  PHE  46           HB3      PHE  46  10.701   3.692   5.489
  350    HB3  PHE  46           HB2      PHE  46  11.504   2.920   4.126
  351    HD1  PHE  46           HD1      PHE  46   9.678   2.184   7.270
  352    HD2  PHE  46           HD2      PHE  46  10.862   0.797   3.427
  353    HE1  PHE  46           HE1      PHE  46   8.221   0.219   7.536
  354    HE2  PHE  46           HE2      PHE  46   9.407  -1.169   3.685
  355    HZ   PHE  46           HZ       PHE  46   8.084  -1.462   5.741
  356    H    THR  47           H        THR  47  12.727   0.527   7.231
  357    HA   THR  47           HA       THR  47  14.918  -0.550   5.703
  358    HB   THR  47           HB       THR  47  13.964  -0.942   8.268
  359    HG1  THR  47           HG1      THR  47  15.655  -2.469   8.363
  360   HG21  THR  47          HG21      THR  47  13.624  -3.414   8.370
  361   HG22  THR  47          HG22      THR  47  13.357  -3.384   6.628
  362   HG23  THR  47          HG23      THR  47  12.272  -2.499   7.702
  363    H    TYR  48           H        TYR  48  14.396  -1.065   3.665
  364    HA   TYR  48           HA       TYR  48  11.889  -2.195   2.908
  365    HB2  TYR  48           HB3      TYR  48  13.830  -2.679   0.891
  366    HB3  TYR  48           HB2      TYR  48  12.565  -1.458   0.911
  367    HD1  TYR  48           HD1      TYR  48  15.993  -2.062   2.271
  368    HD2  TYR  48           HD2      TYR  48  13.186   0.771   0.787
  369    HE1  TYR  48           HE1      TYR  48  17.710  -0.307   2.388
  370    HE2  TYR  48           HE2      TYR  48  14.897   2.533   0.899
  371    HH   TYR  48           HH       TYR  48  17.992   1.997   2.414
  372    H    THR  49           H        THR  49  11.614  -4.239   1.823
  373    HA   THR  49           HA       THR  49  12.869  -6.400   3.264
  374    HB   THR  49           HB       THR  49  11.269  -7.826   2.164
  375    HG1  THR  49           HG1      THR  49   9.841  -6.754   0.566
  376   HG21  THR  49          HG21      THR  49   9.370  -5.659   2.321
  377   HG22  THR  49          HG22      THR  49  10.465  -5.677   3.703
  378   HG23  THR  49          HG23      THR  49   9.517  -7.111   3.311
  379    H    ASP  50           H        ASP  50  13.539  -8.387   1.872
  380    HA   ASP  50           HA       ASP  50  15.819  -7.727   0.443
  381    HB2  ASP  50           HB3      ASP  50  15.842  -9.937   1.106
  382    HB3  ASP  50           HB2      ASP  50  14.152 -10.192   0.683
  383    H    ALA  51           H        ALA  51  12.516  -8.194  -0.659
  384    HA   ALA  51           HA       ALA  51  13.104  -8.135  -3.444
  385    HB1  ALA  51           HB1      ALA  51  10.980  -8.761  -3.575
  386    HB2  ALA  51           HB2      ALA  51  10.455  -7.206  -2.931
  387    HB3  ALA  51           HB3      ALA  51  10.822  -8.537  -1.833
  388    H    ASN  52           H        ASN  52  11.999  -5.678  -1.123
  389    HA   ASN  52           HA       ASN  52  11.705  -3.570  -2.949
  390    HB2  ASN  52           HB3      ASN  52  12.408  -3.498  -0.007
  391    HB3  ASN  52           HB2      ASN  52  11.930  -2.091  -0.955
  392   HD21  ASN  52          HD21      ASN  52  10.143  -4.163  -2.432
  393   HD22  ASN  52          HD22      ASN  52   8.732  -4.220  -1.435
  394    H    LYS  53           H        LYS  53  14.486  -4.584  -1.003
  395    HA   LYS  53           HA       LYS  53  16.228  -2.512  -1.709
  396    HB2  LYS  53           HB3      LYS  53  18.039  -4.213  -1.180
  397    HB3  LYS  53           HB2      LYS  53  16.867  -3.909   0.096
  398    HG2  LYS  53           HG3      LYS  53  15.733  -5.954  -0.355
  399    HG3  LYS  53           HG2      LYS  53  16.685  -6.222  -1.817
  400    HD2  LYS  53           HD3      LYS  53  17.817  -7.576  -0.363
  401    HD3  LYS  53           HD2      LYS  53  18.697  -6.067  -0.112
  402    HE2  LYS  53           HE3      LYS  53  18.173  -6.136   2.042
  403    HE3  LYS  53           HE2      LYS  53  16.465  -6.033   1.620
  404    HZ1  LYS  53           HZ1      LYS  53  17.963  -8.267   2.583
  405    HZ2  LYS  53           HZ2      LYS  53  17.123  -8.645   1.164
  406    HZ3  LYS  53           HZ3      LYS  53  16.287  -8.046   2.510
  407    H    ASN  54           H        ASN  54  15.256  -5.414  -3.373
  408    HA   ASN  54           HA       ASN  54  17.307  -5.294  -5.376
  409    HB2  ASN  54           HB3      ASN  54  14.671  -6.783  -5.373
  410    HB3  ASN  54           HB2      ASN  54  15.987  -7.036  -6.513
  411   HD21  ASN  54          HD21      ASN  54  17.328  -6.300  -3.604
  412   HD22  ASN  54          HD22      ASN  54  17.597  -7.895  -2.998
  413    H    LYS  55           H        LYS  55  14.380  -3.675  -4.802
  414    HA   LYS  55           HA       LYS  55  13.358  -1.976  -5.930
  415    HB2  LYS  55           HB3      LYS  55  15.663  -2.434  -7.813
  416    HB3  LYS  55           HB2      LYS  55  14.397  -1.268  -8.165
  417    HG2  LYS  55           HG3      LYS  55  15.206   0.227  -6.718
  418    HG3  LYS  55           HG2      LYS  55  15.534  -0.997  -5.488
  419    HD2  LYS  55           HD3      LYS  55  17.252  -0.177  -7.815
  420    HD3  LYS  55           HD2      LYS  55  17.641  -0.134  -6.094
  421    HE2  LYS  55           HE3      LYS  55  17.249  -2.716  -6.251
  422    HE3  LYS  55           HE2      LYS  55  17.553  -2.456  -7.968
  423    HZ1  LYS  55           HZ1      LYS  55  19.627  -2.943  -7.066
  424    HZ2  LYS  55           HZ2      LYS  55  19.376  -1.994  -5.690
  425    HZ3  LYS  55           HZ3      LYS  55  19.640  -1.256  -7.189
  426    H    GLY  56           H        GLY  56  11.897  -4.025  -5.993
  427    HA2  GLY  56           HA3      GLY  56  11.482  -5.505  -8.300
  428    HA3  GLY  56           HA2      GLY  56  10.225  -5.093  -7.143
  429    H    ILE  57           H        ILE  57   8.651  -3.715  -7.755
  430    HA   ILE  57           HA       ILE  57   9.151  -1.888  -9.943
  431    HB   ILE  57           HB       ILE  57   8.006  -4.293 -10.559
  432   HG12  ILE  57          HG13      ILE  57   8.889  -3.157 -12.311
  433   HG13  ILE  57          HG12      ILE  57   7.190  -2.805 -12.605
  434   HG21  ILE  57          HG21      ILE  57   5.918  -3.942  -9.557
  435   HG22  ILE  57          HG22      ILE  57   5.673  -3.564 -11.260
  436   HG23  ILE  57          HG23      ILE  57   5.858  -2.262 -10.085
  437   HD11  ILE  57          HD11      ILE  57   7.415  -0.631 -12.049
  438   HD12  ILE  57          HD12      ILE  57   9.077  -0.934 -12.557
  439   HD13  ILE  57          HD13      ILE  57   8.658  -0.954 -10.841
  440    H    THR  58           H        THR  58   7.166  -0.502 -10.389
  441    HA   THR  58           HA       THR  58   6.278   0.555  -7.871
  442    HB   THR  58           HB       THR  58   6.736   1.582 -10.442
  443    HG1  THR  58           HG1      THR  58   6.249   3.554  -9.376
  444   HG21  THR  58          HG21      THR  58   4.380   1.061 -10.992
  445   HG22  THR  58          HG22      THR  58   4.750   2.785 -11.015
  446   HG23  THR  58          HG23      THR  58   3.879   2.089  -9.648
  447    H    TRP  59           H        TRP  59   4.606  -0.219  -6.860
  448    HA   TRP  59           HA       TRP  59   2.658  -1.919  -8.008
  449    HB2  TRP  59           HB3      TRP  59   1.975  -0.524  -5.489
  450    HB3  TRP  59           HB2      TRP  59   1.964  -2.246  -5.866
  451    HD1  TRP  59           HD1      TRP  59   4.412   0.549  -4.830
  452    HE1  TRP  59           HE1      TRP  59   6.454  -0.543  -3.708
  453    HE3  TRP  59           HE3      TRP  59   3.242  -4.366  -5.616
  454    HZ2  TRP  59           HZ2      TRP  59   7.438  -3.141  -3.216
  455    HZ3  TRP  59           HZ3      TRP  59   4.788  -6.094  -4.787
  456    HH2  TRP  59           HH2      TRP  59   6.842  -5.492  -3.613
  457    H    LYS  60           H        LYS  60   1.253  -1.234  -9.468
  458    HA   LYS  60           HA       LYS  60   0.033   1.418  -9.171
  459    HB2  LYS  60           HB3      LYS  60   0.374   1.568 -11.373
  460    HB3  LYS  60           HB2      LYS  60   0.973  -0.084 -11.418
  461    HG2  LYS  60           HG3      LYS  60  -0.752  -0.395 -12.813
  462    HG3  LYS  60           HG2      LYS  60  -1.683  -0.542 -11.323
  463    HD2  LYS  60           HD3      LYS  60  -2.788   1.372 -11.695
  464    HD3  LYS  60           HD2      LYS  60  -1.328   2.219 -12.212
  465    HE2  LYS  60           HE3      LYS  60  -1.979   0.303 -14.201
  466    HE3  LYS  60           HE2      LYS  60  -3.452   1.186 -13.800
  467    HZ1  LYS  60           HZ1      LYS  60  -1.515   2.032 -15.499
  468    HZ2  LYS  60           HZ2      LYS  60  -1.159   2.887 -14.086
  469    HZ3  LYS  60           HZ3      LYS  60  -2.692   3.017 -14.787
  470    H    GLU  61           H        GLU  61  -2.316   1.476 -10.026
  471    HA   GLU  61           HA       GLU  61  -3.912  -0.033  -8.283
  472    HB2  GLU  61           HB3      GLU  61  -4.281   2.162  -9.934
  473    HB3  GLU  61           HB2      GLU  61  -5.342   0.943 -10.629
  474    HG2  GLU  61           HG3      GLU  61  -5.646   0.924  -7.797
  475    HG3  GLU  61           HG2      GLU  61  -5.791   2.581  -8.381
  476    H    GLU  62           H        GLU  62  -3.677  -0.254 -11.839
  477    HA   GLU  62           HA       GLU  62  -5.270  -2.558 -12.082
  478    HB2  GLU  62           HB3      GLU  62  -4.769  -2.496 -14.326
  479    HB3  GLU  62           HB2      GLU  62  -4.404  -0.840 -13.868
  480    HG2  GLU  62           HG3      GLU  62  -2.022  -1.472 -13.652
  481    HG3  GLU  62           HG2      GLU  62  -2.433  -3.081 -14.245
  482    H    THR  63           H        THR  63  -1.755  -2.169 -11.832
  483    HA   THR  63           HA       THR  63  -1.091  -4.881 -12.208
  484    HB   THR  63           HB       THR  63   0.290  -2.474 -11.700
  485    HG1  THR  63           HG1      THR  63   1.612  -3.525 -12.922
  486   HG21  THR  63          HG21      THR  63   1.779  -2.818  -9.991
  487   HG22  THR  63          HG22      THR  63   1.476  -4.556  -9.933
  488   HG23  THR  63          HG23      THR  63   0.282  -3.431  -9.290
  489    H    LEU  64           H        LEU  64  -2.215  -3.089  -9.460
  490    HA   LEU  64           HA       LEU  64  -1.479  -4.992  -7.471
  491    HB2  LEU  64           HB3      LEU  64  -2.936  -2.469  -7.607
  492    HB3  LEU  64           HB2      LEU  64  -3.644  -3.593  -6.463
  493    HG   LEU  64           HG       LEU  64  -0.795  -2.596  -6.449
  494   HD11  LEU  64          HD11      LEU  64  -1.881  -0.842  -5.515
  495   HD12  LEU  64          HD12      LEU  64  -1.801  -1.874  -4.086
  496   HD13  LEU  64          HD13      LEU  64  -3.277  -1.812  -5.048
  497   HD21  LEU  64          HD21      LEU  64  -0.510  -3.851  -4.414
  498   HD22  LEU  64          HD22      LEU  64  -1.012  -4.945  -5.703
  499   HD23  LEU  64          HD23      LEU  64  -2.177  -4.420  -4.487
  500    H    MET  65           H        MET  65  -4.285  -4.466  -9.508
  501    HA   MET  65           HA       MET  65  -6.099  -6.164  -8.209
  502    HB2  MET  65           HB3      MET  65  -5.821  -5.346 -11.099
  503    HB3  MET  65           HB2      MET  65  -7.137  -6.364 -10.532
  504    HG2  MET  65           HG3      MET  65  -6.537  -3.525  -9.760
  505    HG3  MET  65           HG2      MET  65  -7.946  -4.141 -10.623
  506    HE1  MET  65           HE1      MET  65  -6.462  -3.060  -7.412
  507    HE2  MET  65           HE2      MET  65  -6.017  -4.744  -7.134
  508    HE3  MET  65           HE3      MET  65  -7.253  -3.981  -6.133
  509    H    GLU  66           H        GLU  66  -3.685  -6.809 -10.711
  510    HA   GLU  66           HA       GLU  66  -4.343  -9.605 -10.877
  511    HB2  GLU  66           HB3      GLU  66  -2.109  -9.642 -12.176
  512    HB3  GLU  66           HB2      GLU  66  -3.465  -8.767 -12.873
  513    HG2  GLU  66           HG3      GLU  66  -2.553  -6.667 -12.118
  514    HG3  GLU  66           HG2      GLU  66  -1.237  -7.504 -11.293
  515    H    TYR  67           H        TYR  67  -1.938  -7.620  -9.264
  516    HA   TYR  67           HA       TYR  67  -0.239  -9.663  -8.357
  517    HB2  TYR  67           HB3      TYR  67   0.759  -7.636  -8.031
  518    HB3  TYR  67           HB2      TYR  67  -0.756  -6.834  -7.638
  519    HD1  TYR  67           HD1      TYR  67   2.140  -8.587  -6.319
  520    HD2  TYR  67           HD2      TYR  67  -1.667  -6.953  -5.348
  521    HE1  TYR  67           HE1      TYR  67   2.721  -8.666  -3.930
  522    HE2  TYR  67           HE2      TYR  67  -1.094  -7.026  -2.956
  523    HH   TYR  67           HH       TYR  67   0.727  -7.178  -1.502
  524    H    LEU  68           H        LEU  68  -3.369  -8.654  -7.333
  525    HA   LEU  68           HA       LEU  68  -3.344  -9.528  -4.666
  526    HB2  LEU  68           HB3      LEU  68  -5.515  -9.164  -6.705
  527    HB3  LEU  68           HB2      LEU  68  -5.877  -9.840  -5.128
  528    HG   LEU  68           HG       LEU  68  -4.584  -7.146  -5.547
  529   HD11  LEU  68          HD11      LEU  68  -6.704  -6.146  -5.150
  530   HD12  LEU  68          HD12      LEU  68  -7.448  -7.712  -4.814
  531   HD13  LEU  68          HD13      LEU  68  -6.913  -7.322  -6.449
  532   HD21  LEU  68          HD21      LEU  68  -4.069  -8.131  -3.397
  533   HD22  LEU  68          HD22      LEU  68  -5.777  -8.475  -3.118
  534   HD23  LEU  68          HD23      LEU  68  -5.213  -6.805  -3.190
  535    H    GLU  69           H        GLU  69  -3.215 -11.277  -7.577
  536    HA   GLU  69           HA       GLU  69  -4.560 -13.640  -6.895
  537    HB2  GLU  69           HB3      GLU  69  -3.174 -12.729  -9.088
  538    HB3  GLU  69           HB2      GLU  69  -2.136 -14.022  -8.498
  539    HG2  GLU  69           HG3      GLU  69  -3.996 -15.583  -8.602
  540    HG3  GLU  69           HG2      GLU  69  -5.063 -14.291  -9.149
  541    H    ASN  70           H        ASN  70  -1.033 -13.551  -7.203
  542    HA   ASN  70           HA       ASN  70  -0.860 -15.109  -4.707
  543    HB2  ASN  70           HB3      ASN  70   0.550 -15.406  -7.332
  544    HB3  ASN  70           HB2      ASN  70   1.369 -15.905  -5.853
  545   HD21  ASN  70          HD21      ASN  70  -0.968 -16.686  -8.195
  546   HD22  ASN  70          HD22      ASN  70  -1.504 -18.177  -7.505
  547    HA   PRO  71           HA       PRO  71   1.187 -11.138  -3.656
  548    HB2  PRO  71           HB3      PRO  71   1.156 -12.627  -1.071
  549    HB3  PRO  71           HB2      PRO  71   0.740 -10.941  -1.404
  550    HG2  PRO  71           HG3      PRO  71  -1.166 -12.749  -0.976
  551    HG3  PRO  71           HG2      PRO  71  -1.371 -11.482  -2.199
  552    HD2  PRO  71           HD3      PRO  71  -0.754 -14.377  -2.556
  553    HD3  PRO  71           HD2      PRO  71  -1.725 -13.295  -3.575
  554    H    LYS  72           H        LYS  72   2.103 -14.456  -2.903
  555    HA   LYS  72           HA       LYS  72   4.822 -13.769  -2.257
  556    HB2  LYS  72           HB3      LYS  72   4.802 -15.795  -1.322
  557    HB3  LYS  72           HB2      LYS  72   3.153 -16.010  -1.892
  558    HG2  LYS  72           HG3      LYS  72   4.145 -17.851  -2.798
  559    HG3  LYS  72           HG2      LYS  72   4.355 -16.703  -4.121
  560    HD2  LYS  72           HD3      LYS  72   6.542 -16.445  -2.300
  561    HD3  LYS  72           HD2      LYS  72   6.344 -18.147  -2.728
  562    HE2  LYS  72           HE3      LYS  72   6.029 -16.681  -5.109
  563    HE3  LYS  72           HE2      LYS  72   7.429 -15.996  -4.284
  564    HZ1  LYS  72           HZ1      LYS  72   8.395 -18.195  -4.142
  565    HZ2  LYS  72           HZ2      LYS  72   8.037 -17.828  -5.754
  566    HZ3  LYS  72           HZ3      LYS  72   7.037 -18.879  -4.886
  567    H    LYS  73           H        LYS  73   3.038 -14.565  -5.097
  568    HA   LYS  73           HA       LYS  73   5.202 -15.504  -6.685
  569    HB2  LYS  73           HB3      LYS  73   3.698 -15.581  -8.437
  570    HB3  LYS  73           HB2      LYS  73   2.617 -15.688  -7.055
  571    HG2  LYS  73           HG3      LYS  73   1.506 -14.076  -8.162
  572    HG3  LYS  73           HG2      LYS  73   2.682 -13.023  -7.372
  573    HD2  LYS  73           HD3      LYS  73   2.321 -12.734  -9.894
  574    HD3  LYS  73           HD2      LYS  73   3.984 -12.832  -9.307
  575    HE2  LYS  73           HE3      LYS  73   3.460 -14.193 -11.366
  576    HE3  LYS  73           HE2      LYS  73   4.207 -15.072 -10.032
  577    HZ1  LYS  73           HZ1      LYS  73   1.863 -15.701  -9.382
  578    HZ2  LYS  73           HZ2      LYS  73   2.468 -16.422 -10.788
  579    HZ3  LYS  73           HZ3      LYS  73   1.379 -15.132 -10.901
  580    H    TYR  74           H        TYR  74   3.949 -12.344  -5.895
  581    HA   TYR  74           HA       TYR  74   5.466 -10.998  -7.949
  582    HB2  TYR  74           HB3      TYR  74   3.520 -10.222  -5.859
  583    HB3  TYR  74           HB2      TYR  74   4.719  -9.001  -6.280
  584    HD1  TYR  74           HD1      TYR  74   2.212 -11.287  -7.823
  585    HD2  TYR  74           HD2      TYR  74   4.380  -7.640  -8.137
  586    HE1  TYR  74           HE1      TYR  74   0.884 -10.676  -9.801
  587    HE2  TYR  74           HE2      TYR  74   3.058  -7.018 -10.115
  588    HH   TYR  74           HH       TYR  74   0.812  -9.258 -11.605
  589    H    ILE  75           H        ILE  75   5.668 -11.399  -4.430
  590    HA   ILE  75           HA       ILE  75   8.500 -10.628  -4.592
  591    HB   ILE  75           HB       ILE  75   6.481  -9.659  -2.578
  592   HG12  ILE  75          HG13      ILE  75   6.563  -8.124  -4.334
  593   HG13  ILE  75          HG12      ILE  75   7.738  -7.467  -3.198
  594   HG21  ILE  75          HG21      ILE  75   8.496  -8.618  -1.445
  595   HG22  ILE  75          HG22      ILE  75   9.477  -9.752  -2.373
  596   HG23  ILE  75          HG23      ILE  75   8.279 -10.353  -1.227
  597   HD11  ILE  75          HD11      ILE  75   9.062  -7.353  -4.991
  598   HD12  ILE  75          HD12      ILE  75   8.112  -8.537  -5.893
  599   HD13  ILE  75          HD13      ILE  75   9.307  -9.077  -4.714
  600    HA   PRO  76           HA       PRO  76   7.973 -14.832  -2.670
  601    HB2  PRO  76           HB3      PRO  76  10.683 -15.045  -3.858
  602    HB3  PRO  76           HB2      PRO  76   9.327 -16.174  -3.939
  603    HG2  PRO  76           HG3      PRO  76  10.010 -14.697  -6.054
  604    HG3  PRO  76           HG2      PRO  76   8.309 -15.032  -5.680
  605    HD2  PRO  76           HD3      PRO  76   9.898 -12.541  -5.220
  606    HD3  PRO  76           HD2      PRO  76   8.209 -12.722  -5.743
  607    H    GLY  77           H        GLY  77   8.606 -15.273  -0.644
  608    HA2  GLY  77           HA3      GLY  77  10.343 -15.509   1.010
  609    HA3  GLY  77           HA2      GLY  77  11.122 -14.091   0.328
  610    H    THR  78           H        THR  78   8.260 -12.911   0.200
  611    HA   THR  78           HA       THR  78   8.343 -11.863   2.936
  612    HB   THR  78           HB       THR  78   8.179 -10.562   0.520
  613    HG1  THR  78           HG1      THR  78   7.193  -9.567   2.981
  614   HG21  THR  78          HG21      THR  78   5.740 -11.342   0.459
  615   HG22  THR  78          HG22      THR  78   6.084  -9.636   0.178
  616   HG23  THR  78          HG23      THR  78   5.484 -10.168   1.749
  617    H    LYS  79           H        LYS  79   6.817 -12.335   4.371
  618    HA   LYS  79           HA       LYS  79   4.410 -13.735   3.426
  619    HB2  LYS  79           HB3      LYS  79   6.114 -14.770   5.116
  620    HB3  LYS  79           HB2      LYS  79   5.308 -13.733   6.285
  621    HG2  LYS  79           HG3      LYS  79   4.518 -16.179   5.970
  622    HG3  LYS  79           HG2      LYS  79   3.325 -14.892   6.153
  623    HD2  LYS  79           HD3      LYS  79   2.795 -16.498   4.328
  624    HD3  LYS  79           HD2      LYS  79   2.947 -14.825   3.783
  625    HE2  LYS  79           HE3      LYS  79   4.056 -16.465   2.286
  626    HE3  LYS  79           HE2      LYS  79   5.149 -15.241   2.927
  627    HZ1  LYS  79           HZ1      LYS  79   6.049 -17.536   2.971
  628    HZ2  LYS  79           HZ2      LYS  79   4.848 -17.956   4.085
  629    HZ3  LYS  79           HZ3      LYS  79   6.009 -16.796   4.493
  630    H    MET  80           H        MET  80   2.372 -13.019   4.111
  631    HA   MET  80           HA       MET  80   2.403 -10.379   5.402
  632    HB2  MET  80           HB3      MET  80   1.296 -10.757   3.117
  633    HB3  MET  80           HB2      MET  80   0.044 -11.621   4.001
  634    HG2  MET  80           HG3      MET  80  -0.885  -9.550   3.916
  635    HG3  MET  80           HG2      MET  80  -0.003  -9.423   5.435
  636    HE1  MET  80           HE1      MET  80   2.079  -9.527   2.150
  637    HE2  MET  80           HE2      MET  80   1.890  -7.887   1.528
  638    HE3  MET  80           HE3      MET  80   0.508  -8.981   1.564
  639    H    ILE  81           H        ILE  81   2.087 -10.456   7.121
  640    HA   ILE  81           HA       ILE  81   0.291 -12.511   8.620
  641    HB   ILE  81           HB       ILE  81   2.275 -10.601   9.962
  642   HG12  ILE  81          HG13      ILE  81   3.179 -13.060  10.492
  643   HG13  ILE  81          HG12      ILE  81   2.256 -13.437   9.037
  644   HG21  ILE  81          HG21      ILE  81   1.249 -12.854  11.555
  645   HG22  ILE  81          HG22      ILE  81   0.119 -11.508  11.310
  646   HG23  ILE  81          HG23      ILE  81   1.707 -11.221  12.040
  647   HD11  ILE  81          HD11      ILE  81   4.311 -12.986   8.145
  648   HD12  ILE  81          HD12      ILE  81   4.698 -11.768   9.364
  649   HD13  ILE  81          HD13      ILE  81   3.567 -11.385   8.070
  650    H    PHE  82           H        PHE  82  -1.685 -11.885   9.765
  651    HA   PHE  82           HA       PHE  82  -3.226 -10.568  10.878
  652    HB2  PHE  82           HB3      PHE  82  -1.133  -9.095  11.419
  653    HB3  PHE  82           HB2      PHE  82  -1.759  -8.057  10.141
  654    HD1  PHE  82           HD1      PHE  82  -2.368  -9.400  13.495
  655    HD2  PHE  82           HD2      PHE  82  -3.766  -6.779  10.447
  656    HE1  PHE  82           HE1      PHE  82  -3.913  -8.361  15.104
  657    HE2  PHE  82           HE2      PHE  82  -5.313  -5.733  12.050
  658    HZ   PHE  82           HZ       PHE  82  -5.387  -6.524  14.383
  659    H    ALA  83           H        ALA  83  -4.885  -8.919  10.250
  660    HA   ALA  83           HA       ALA  83  -5.417  -7.489   8.164
  661    HB1  ALA  83           HB1      ALA  83  -6.147  -9.286   6.356
  662    HB2  ALA  83           HB2      ALA  83  -4.860 -10.214   7.124
  663    HB3  ALA  83           HB3      ALA  83  -4.508  -8.636   6.418
  664    H    GLY  84           H        GLY  84  -7.112  -7.048   9.600
  665    HA2  GLY  84           HA3      GLY  84  -9.138  -9.029  10.140
  666    HA3  GLY  84           HA2      GLY  84  -9.169  -7.343  10.633
  667    H    ILE  85           H        ILE  85  -8.525  -7.811   7.332
  668    HA   ILE  85           HA       ILE  85 -11.359  -7.460   6.629
  669    HB   ILE  85           HB       ILE  85  -9.063  -5.849   5.513
  670   HG12  ILE  85          HG13      ILE  85 -10.591  -5.423   7.803
  671   HG13  ILE  85          HG12      ILE  85  -9.614  -4.225   6.960
  672   HG21  ILE  85          HG21      ILE  85 -11.987  -5.792   4.784
  673   HG22  ILE  85          HG22      ILE  85 -10.687  -6.444   3.787
  674   HG23  ILE  85          HG23      ILE  85 -10.738  -4.718   4.151
  675   HD11  ILE  85          HD11      ILE  85 -11.744  -3.921   5.501
  676   HD12  ILE  85          HD12      ILE  85 -11.648  -3.173   7.096
  677   HD13  ILE  85          HD13      ILE  85 -12.556  -4.668   6.876
  678    H    LYS  86           H        LYS  86 -11.988  -8.275   4.629
  679    HA   LYS  86           HA       LYS  86 -10.009  -9.538   2.921
  680    HB2  LYS  86           HB3      LYS  86 -11.624 -11.641   2.999
  681    HB3  LYS  86           HB2      LYS  86 -10.279 -11.469   4.117
  682    HG2  LYS  86           HG3      LYS  86 -12.543 -10.164   5.236
  683    HG3  LYS  86           HG2      LYS  86 -13.025 -11.776   4.703
  684    HD2  LYS  86           HD3      LYS  86 -11.559 -12.833   6.138
  685    HD3  LYS  86           HD2      LYS  86 -10.484 -11.438   6.234
  686    HE2  LYS  86           HE3      LYS  86 -12.581 -10.320   7.361
  687    HE3  LYS  86           HE2      LYS  86 -13.019 -11.995   7.697
  688    HZ1  LYS  86           HZ1      LYS  86 -10.337 -10.954   8.368
  689    HZ2  LYS  86           HZ2      LYS  86 -11.137 -12.303   9.001
  690    HZ3  LYS  86           HZ3      LYS  86 -11.643 -10.745   9.425
  691    H    LYS  87           H        LYS  87 -13.395  -8.849   3.596
  692    HA   LYS  87           HA       LYS  87 -14.738  -9.454   1.371
  693    HB2  LYS  87           HB3      LYS  87 -15.043  -7.568   3.420
  694    HB3  LYS  87           HB2      LYS  87 -15.237  -6.664   1.926
  695    HG2  LYS  87           HG3      LYS  87 -17.327  -7.380   1.823
  696    HG3  LYS  87           HG2      LYS  87 -16.717  -9.021   1.598
  697    HD2  LYS  87           HD3      LYS  87 -16.542  -9.140   4.131
  698    HD3  LYS  87           HD2      LYS  87 -17.499  -7.659   4.164
  699    HE2  LYS  87           HE3      LYS  87 -18.826  -9.762   4.423
  700    HE3  LYS  87           HE2      LYS  87 -19.335  -8.731   3.086
  701    HZ1  LYS  87           HZ1      LYS  87 -19.058 -11.262   2.721
  702    HZ2  LYS  87           HZ2      LYS  87 -17.411 -10.901   2.597
  703    HZ3  LYS  87           HZ3      LYS  87 -18.515 -10.190   1.533
  704    H    LYS  88           H        LYS  88 -14.270  -9.325  -0.720
  705    HA   LYS  88           HA       LYS  88 -12.221  -7.915  -1.888
  706    HB2  LYS  88           HB3      LYS  88 -13.389  -9.715  -3.037
  707    HB3  LYS  88           HB2      LYS  88 -14.850  -8.740  -3.131
  708    HG2  LYS  88           HG3      LYS  88 -13.858  -7.243  -4.676
  709    HG3  LYS  88           HG2      LYS  88 -12.254  -7.935  -4.415
  710    HD2  LYS  88           HD3      LYS  88 -14.476  -8.880  -6.098
  711    HD3  LYS  88           HD2      LYS  88 -12.734  -9.081  -6.298
  712    HE2  LYS  88           HE3      LYS  88 -13.700 -11.239  -5.920
  713    HE3  LYS  88           HE2      LYS  88 -12.789 -10.782  -4.481
  714    HZ1  LYS  88           HZ1      LYS  88 -15.432 -11.567  -4.604
  715    HZ2  LYS  88           HZ2      LYS  88 -15.474  -9.909  -4.273
  716    HZ3  LYS  88           HZ3      LYS  88 -14.612 -10.951  -3.259
  717    H    THR  89           H        THR  89 -15.536  -6.884  -1.312
  718    HA   THR  89           HA       THR  89 -15.373  -4.461  -2.780
  719    HB   THR  89           HB       THR  89 -17.505  -4.016  -2.009
  720    HG1  THR  89           HG1      THR  89 -17.389  -3.791   0.112
  721   HG21  THR  89          HG21      THR  89 -17.391  -6.947  -1.369
  722   HG22  THR  89          HG22      THR  89 -17.445  -6.300  -3.009
  723   HG23  THR  89          HG23      THR  89 -18.786  -6.008  -1.901
  724    H    GLU  90           H        GLU  90 -14.517  -5.383   0.470
  725    HA   GLU  90           HA       GLU  90 -14.274  -2.717   1.483
  726    HB2  GLU  90           HB3      GLU  90 -13.032  -5.263   2.540
  727    HB3  GLU  90           HB2      GLU  90 -13.226  -3.754   3.421
  728    HG2  GLU  90           HG3      GLU  90 -15.694  -4.913   2.317
  729    HG3  GLU  90           HG2      GLU  90 -14.916  -5.835   3.601
  730    H    ARG  91           H        ARG  91 -12.005  -5.175   0.335
  731    HA   ARG  91           HA       ARG  91  -9.643  -3.697   0.694
  732    HB2  ARG  91           HB3      ARG  91 -10.162  -5.907  -1.245
  733    HB3  ARG  91           HB2      ARG  91  -8.618  -5.077  -1.098
  734    HG2  ARG  91           HG3      ARG  91  -9.085  -5.727   1.484
  735    HG3  ARG  91           HG2      ARG  91  -9.876  -7.080   0.652
  736    HD2  ARG  91           HD3      ARG  91  -7.234  -6.894  -0.614
  737    HD3  ARG  91           HD2      ARG  91  -7.126  -6.615   1.122
  738    HE   ARG  91           HE       ARG  91  -8.466  -8.747   1.131
  739   HH11  ARG  91          HH11      ARG  91  -6.055  -7.784  -1.190
  740   HH12  ARG  91          HH12      ARG  91  -5.535  -9.403  -1.517
  741   HH21  ARG  91          HH21      ARG  91  -7.790 -10.885   0.708
  742   HH22  ARG  91          HH22      ARG  91  -6.521 -11.168  -0.437
  743    H    GLU  92           H        GLU  92 -11.658  -4.152  -2.202
  744    HA   GLU  92           HA       GLU  92 -10.179  -2.520  -3.920
  745    HB2  GLU  92           HB3      GLU  92 -12.037  -4.117  -4.544
  746    HB3  GLU  92           HB2      GLU  92 -13.173  -2.882  -4.016
  747    HG2  GLU  92           HG3      GLU  92 -12.937  -2.782  -6.398
  748    HG3  GLU  92           HG2      GLU  92 -12.224  -1.337  -5.682
  749    H    ASP  93           H        ASP  93 -12.783  -1.741  -1.667
  750    HA   ASP  93           HA       ASP  93 -13.234   0.907  -2.445
  751    HB2  ASP  93           HB3      ASP  93 -14.796  -0.057  -0.951
  752    HB3  ASP  93           HB2      ASP  93 -13.541  -0.509   0.197
  753    H    GLY  94           H        GLY  94 -10.991  -0.424  -0.031
  754    HA2  GLY  94           HA3      GLY  94  -9.925   2.007   0.865
  755    HA3  GLY  94           HA2      GLY  94  -9.096   0.457   0.917
  756    H    ILE  95           H        ILE  95  -9.118   0.015  -1.921
  757    HA   ILE  95           HA       ILE  95  -6.712   1.261  -2.631
  758    HB   ILE  95           HB       ILE  95  -8.699  -0.441  -4.011
  759   HG12  ILE  95          HG13      ILE  95  -5.701  -0.426  -3.682
  760   HG13  ILE  95          HG12      ILE  95  -6.863  -1.473  -2.870
  761   HG21  ILE  95          HG21      ILE  95  -8.558   0.596  -5.974
  762   HG22  ILE  95          HG22      ILE  95  -6.876   0.074  -6.022
  763   HG23  ILE  95          HG23      ILE  95  -7.284   1.674  -5.401
  764   HD11  ILE  95          HD11      ILE  95  -6.542  -1.492  -5.845
  765   HD12  ILE  95          HD12      ILE  95  -7.256  -2.717  -4.795
  766   HD13  ILE  95          HD13      ILE  95  -5.513  -2.453  -4.781
  767    H    ALA  96           H        ALA  96 -10.073   2.057  -3.403
  768    HA   ALA  96           HA       ALA  96  -9.619   4.021  -5.335
  769    HB1  ALA  96           HB1      ALA  96 -11.846   3.184  -4.895
  770    HB2  ALA  96           HB2      ALA  96 -11.822   4.933  -4.662
  771    HB3  ALA  96           HB3      ALA  96 -11.811   3.856  -3.265
  772    H    TYR  97           H        TYR  97  -9.873   4.295  -1.807
  773    HA   TYR  97           HA       TYR  97  -9.442   7.065  -1.631
  774    HB2  TYR  97           HB3      TYR  97 -10.265   5.967   0.309
  775    HB3  TYR  97           HB2      TYR  97  -8.949   4.800   0.301
  776    HD1  TYR  97           HD1      TYR  97  -7.999   5.115   2.426
  777    HD2  TYR  97           HD2      TYR  97  -8.698   8.489  -0.070
  778    HE1  TYR  97           HE1      TYR  97  -6.736   6.528   3.991
  779    HE2  TYR  97           HE2      TYR  97  -7.436   9.911   1.488
  780    HH   TYR  97           HH       TYR  97  -5.622   8.574   4.138
  781    H    LEU  98           H        LEU  98  -7.261   4.325  -1.800
  782    HA   LEU  98           HA       LEU  98  -4.852   5.662  -1.233
  783    HB2  LEU  98           HB3      LEU  98  -5.636   3.067  -1.867
  784    HB3  LEU  98           HB2      LEU  98  -4.578   3.527  -3.186
  785    HG   LEU  98           HG       LEU  98  -3.790   3.754  -0.285
  786   HD11  LEU  98          HD11      LEU  98  -2.330   1.694  -1.368
  787   HD12  LEU  98          HD12      LEU  98  -3.945   1.423  -2.028
  788   HD13  LEU  98          HD13      LEU  98  -3.710   1.522  -0.284
  789   HD21  LEU  98          HD21      LEU  98  -2.294   3.942  -2.891
  790   HD22  LEU  98          HD22      LEU  98  -1.499   3.737  -1.331
  791   HD23  LEU  98          HD23      LEU  98  -2.466   5.178  -1.645
  792    H    LYS  99           H        LYS  99  -6.711   5.267  -4.184
  793    HA   LYS  99           HA       LYS  99  -4.803   6.093  -6.048
  794    HB2  LYS  99           HB3      LYS  99  -7.755   6.700  -6.221
  795    HB3  LYS  99           HB2      LYS  99  -6.623   6.476  -7.549
  796    HG2  LYS  99           HG3      LYS  99  -7.574   4.361  -5.630
  797    HG3  LYS  99           HG2      LYS  99  -8.030   4.534  -7.326
  798    HD2  LYS  99           HD3      LYS  99  -6.339   2.867  -6.648
  799    HD3  LYS  99           HD2      LYS  99  -5.406   4.413  -7.662
  800    HE2  LYS  99           HE3      LYS  99  -4.211   3.695  -5.934
  801    HE3  LYS  99           HE2      LYS  99  -5.644   3.861  -4.920
  802    HZ1  LYS  99           HZ1      LYS  99  -4.317   1.518  -5.636
  803    HZ2  LYS  99           HZ2      LYS  99  -5.833   1.471  -6.381
  804    HZ3  LYS  99           HZ3      LYS  99  -5.721   1.675  -4.706
  805    H    LYS 100           H        LYS 100  -7.124   7.985  -4.146
  806    HA   LYS 100           HA       LYS 100  -6.275  10.482  -5.279
  807    HB2  LYS 100           HB3      LYS 100  -8.330  10.951  -4.505
  808    HB3  LYS 100           HB2      LYS 100  -8.320   9.558  -3.435
  809    HG2  LYS 100           HG3      LYS 100  -6.984  10.874  -1.814
  810    HG3  LYS 100           HG2      LYS 100  -7.161  12.277  -2.869
  811    HD2  LYS 100           HD3      LYS 100  -9.331  10.769  -1.422
  812    HD3  LYS 100           HD2      LYS 100  -8.832  12.444  -1.179
  813    HE2  LYS 100           HE3      LYS 100  -9.921  11.453  -3.799
  814    HE3  LYS 100           HE2      LYS 100 -10.965  12.051  -2.511
  815    HZ1  LYS 100           HZ1      LYS 100  -9.528  13.525  -4.414
  816    HZ2  LYS 100           HZ2      LYS 100  -8.917  13.909  -2.885
  817    HZ3  LYS 100           HZ3      LYS 100 -10.567  14.097  -3.208
  818    H    ALA 101           H        ALA 101  -5.624   8.635  -2.399
  819    HA   ALA 101           HA       ALA 101  -4.234  10.485  -0.857
  820    HB1  ALA 101           HB1      ALA 101  -3.474   7.593  -0.881
  821    HB2  ALA 101           HB2      ALA 101  -5.054   8.100  -0.286
  822    HB3  ALA 101           HB3      ALA 101  -3.586   8.707   0.481
  823    H    THR 102           H        THR 102  -3.266   8.699  -3.652
  824    HA   THR 102           HA       THR 102  -0.486   9.576  -3.283
  825    HB   THR 102           HB       THR 102  -0.430   7.302  -3.867
  826    HG1  THR 102           HG1      THR 102  -0.913   8.000  -5.540
  827   HG21  THR 102          HG21      THR 102  -2.925   7.863  -5.252
  828   HG22  THR 102          HG22      THR 102  -2.344   6.373  -4.511
  829   HG23  THR 102          HG23      THR 102  -1.843   6.798  -6.148
  830    H    ASN 103           H        ASN 103  -3.419  10.060  -4.928
  831    HA   ASN 103           HA       ASN 103  -2.411  12.458  -6.126
  832    HB2  ASN 103           HB3      ASN 103  -3.809  10.745  -8.114
  833    HB3  ASN 103           HB2      ASN 103  -2.564  11.967  -8.359
  834   HD21  ASN 103          HD21      ASN 103  -3.167   8.667  -7.344
  835   HD22  ASN 103          HD22      ASN 103  -1.573   8.080  -7.653
  836    H    GLU 104           H        GLU 104  -3.889  13.792  -5.373
  837    HA   GLU 104           HA       GLU 104  -6.316  14.333  -6.258
  838    HB2  GLU 104           HB3      GLU 104  -6.486  11.975  -4.454
  839    HB3  GLU 104           HB2      GLU 104  -7.765  13.174  -4.363
  840    HG2  GLU 104           HG3      GLU 104  -7.116  12.397  -7.092
  841    HG3  GLU 104           HG2      GLU 104  -7.668  11.053  -6.095
  842    HHA  HEC 201           HHA      HEC 201   5.224  -5.201   0.512
  843    HHB  HEC 201           HHB      HEC 201  -0.337  -2.456   0.344
  844    HHC  HEC 201           HHC      HEC 201  -2.029  -6.170   5.161
  845    HHD  HEC 201           HHD      HEC 201   4.088  -5.985   6.807
  846   HMA1  HEC 201          HMA1      HEC 201   1.026  -1.148  -1.195
  847   HMA2  HEC 201          HMA2      HEC 201   2.633  -0.330  -0.656
  848   HMA3  HEC 201          HMA3      HEC 201   2.438  -1.585  -1.497
  849   HAA1  HEC 201          HAA1      HEC 201   5.095  -3.044  -1.364
  850   HAA2  HEC 201          HAA2      HEC 201   5.677  -2.435   0.195
  851   HBA1  HEC 201          HBA1      HEC 201   4.224  -0.377  -0.196
  852   HBA2  HEC 201          HBA2      HEC 201   3.965  -0.981  -1.846
  853   HMB1  HEC 201          HMB1      HEC 201  -3.522  -1.946   2.026
  854   HMB2  HEC 201          HMB2      HEC 201  -3.606  -3.210   0.783
  855   HMB3  HEC 201          HMB3      HEC 201  -2.330  -1.966   0.702
  856    HAB  HEC 201           HAB      HEC 201  -3.857  -3.311   4.508
  857   HBB1  HEC 201          HBB1      HEC 201  -5.297  -5.249   2.690
  858   HBB2  HEC 201          HBB2      HEC 201  -4.649  -3.755   1.988
  859   HBB3  HEC 201          HBB3      HEC 201  -5.766  -3.699   3.375
  860   HMC1  HEC 201          HMC1      HEC 201  -0.928  -7.689   8.486
  861   HMC2  HEC 201          HMC2      HEC 201  -1.907  -7.796   6.883
  862   HMC3  HEC 201          HMC3      HEC 201  -0.566  -8.433   7.224
  863    HAC  HEC 201           HAC      HEC 201   3.001  -6.997   8.256
  864   HBC1  HEC 201          HBC1      HEC 201   3.274  -9.385   7.699
  865   HBC2  HEC 201          HBC2      HEC 201   1.622  -9.694   8.271
  866   HBC3  HEC 201          HBC3      HEC 201   2.875  -9.144   9.418
  867   HMD1  HEC 201          HMD1      HEC 201   6.008  -7.192   6.401
  868   HMD2  HEC 201          HMD2      HEC 201   7.166  -5.899   6.027
  869   HMD3  HEC 201          HMD3      HEC 201   7.255  -7.456   5.156
  870   HAD1  HEC 201          HAD1      HEC 201   7.980  -6.444   3.198
  871   HAD2  HEC 201          HAD2      HEC 201   7.593  -5.003   2.243
  872   HBD1  HEC 201          HBD1      HEC 201   7.891  -7.657   1.323
  873   HBD2  HEC 201          HBD2      HEC 201   7.369  -6.237   0.395
  Start of MODEL    6
    1    H1   GLY   1          1H        GLY   1 -19.384   3.956  -0.497
    2    H2   GLY   1          2H        GLY   1 -18.773   3.423  -1.973
    3    H3   GLY   1          3H        GLY   1 -18.945   5.078  -1.673
    4    HA2  GLY   1           HA2      GLY   1 -17.316   3.714   0.271
    5    HA3  GLY   1           HA3      GLY   1 -16.660   3.673  -1.358
    6    H    ASP   2           H        ASP   2 -16.605   5.358   1.454
    7    HA   ASP   2           HA       ASP   2 -16.025   7.902   0.098
    8    HB2  ASP   2           HB3      ASP   2 -16.647   7.579   3.106
    9    HB3  ASP   2           HB2      ASP   2 -16.681   9.072   2.048
   10    H    VAL   3           H        VAL   3 -14.259   9.174   0.971
   11    HA   VAL   3           HA       VAL   3 -11.901   7.678   1.299
   12    HB   VAL   3           HB       VAL   3 -12.596  10.562   1.425
   13   HG11  VAL   3          HG11      VAL   3 -11.272  10.639   3.329
   14   HG12  VAL   3          HG12      VAL   3 -10.114  10.956   2.037
   15   HG13  VAL   3          HG13      VAL   3 -10.208   9.351   2.763
   16   HG21  VAL   3          HG21      VAL   3 -11.837  10.281  -0.654
   17   HG22  VAL   3          HG22      VAL   3 -11.112   8.720  -0.266
   18   HG23  VAL   3          HG23      VAL   3 -10.226  10.209   0.061
   19    H    GLU   4           H        GLU   4 -13.944   9.394   3.625
   20    HA   GLU   4           HA       GLU   4 -12.318   9.097   5.949
   21    HB2  GLU   4           HB3      GLU   4 -14.239  10.563   5.973
   22    HB3  GLU   4           HB2      GLU   4 -15.330   9.207   5.724
   23    HG2  GLU   4           HG3      GLU   4 -14.442   8.308   7.937
   24    HG3  GLU   4           HG2      GLU   4 -13.755   9.912   8.175
   25    H    LYS   5           H        LYS   5 -14.853   6.950   4.698
   26    HA   LYS   5           HA       LYS   5 -14.680   5.035   6.761
   27    HB2  LYS   5           HB3      LYS   5 -15.540   4.594   3.896
   28    HB3  LYS   5           HB2      LYS   5 -15.931   3.574   5.272
   29    HG2  LYS   5           HG3      LYS   5 -16.845   6.030   6.075
   30    HG3  LYS   5           HG2      LYS   5 -17.190   6.027   4.343
   31    HD2  LYS   5           HD3      LYS   5 -17.861   3.528   5.728
   32    HD3  LYS   5           HD2      LYS   5 -18.795   4.932   6.252
   33    HE2  LYS   5           HE3      LYS   5 -20.061   4.764   4.438
   34    HE3  LYS   5           HE2      LYS   5 -18.639   5.004   3.424
   35    HZ1  LYS   5           HZ1      LYS   5 -20.162   2.667   3.781
   36    HZ2  LYS   5           HZ2      LYS   5 -18.586   2.370   4.317
   37    HZ3  LYS   5           HZ3      LYS   5 -18.852   2.925   2.741
   38    H    GLY   6           H        GLY   6 -13.000   5.397   3.684
   39    HA2  GLY   6           HA3      GLY   6 -11.729   2.884   3.632
   40    HA3  GLY   6           HA2      GLY   6 -11.164   4.332   2.815
   41    H    LYS   7           H        LYS   7 -10.684   5.953   4.952
   42    HA   LYS   7           HA       LYS   7  -8.092   5.238   5.615
   43    HB2  LYS   7           HB3      LYS   7  -8.504   7.506   5.828
   44    HB3  LYS   7           HB2      LYS   7 -10.022   7.255   6.681
   45    HG2  LYS   7           HG3      LYS   7  -7.868   6.210   8.245
   46    HG3  LYS   7           HG2      LYS   7  -7.507   7.870   7.767
   47    HD2  LYS   7           HD3      LYS   7 -10.185   7.929   8.498
   48    HD3  LYS   7           HD2      LYS   7  -9.431   6.871   9.692
   49    HE2  LYS   7           HE3      LYS   7  -8.928   8.792  10.741
   50    HE3  LYS   7           HE2      LYS   7  -7.618   8.881   9.565
   51    HZ1  LYS   7           HZ1      LYS   7  -8.545  10.900   9.222
   52    HZ2  LYS   7           HZ2      LYS   7 -10.090  10.420   9.713
   53    HZ3  LYS   7           HZ3      LYS   7  -9.533  10.021   8.166
   54    H    LYS   8           H        LYS   8 -10.895   4.979   7.525
   55    HA   LYS   8           HA       LYS   8  -9.947   3.868   9.942
   56    HB2  LYS   8           HB3      LYS   8 -12.085   4.610  10.228
   57    HB3  LYS   8           HB2      LYS   8 -12.577   4.151   8.603
   58    HG2  LYS   8           HG3      LYS   8 -11.974   1.951  10.480
   59    HG3  LYS   8           HG2      LYS   8 -13.431   2.894  10.792
   60    HD2  LYS   8           HD3      LYS   8 -14.335   2.370   8.666
   61    HD3  LYS   8           HD2      LYS   8 -12.795   1.722   8.094
   62    HE2  LYS   8           HE3      LYS   8 -14.047   0.477  10.487
   63    HE3  LYS   8           HE2      LYS   8 -14.758   0.144   8.906
   64    HZ1  LYS   8           HZ1      LYS   8 -11.877  -0.225   9.504
   65    HZ2  LYS   8           HZ2      LYS   8 -12.725  -0.764   8.143
   66    HZ3  LYS   8           HZ3      LYS   8 -13.021  -1.463   9.653
   67    H    ILE   9           H        ILE   9 -11.041   2.424   6.911
   68    HA   ILE   9           HA       ILE   9 -11.071  -0.256   7.747
   69    HB   ILE   9           HB       ILE   9 -10.860   1.098   5.098
   70   HG12  ILE   9          HG13      ILE   9 -12.705  -1.041   6.187
   71   HG13  ILE   9          HG12      ILE   9 -13.043   0.688   6.201
   72   HG21  ILE   9          HG21      ILE   9 -10.612  -1.957   5.325
   73   HG22  ILE   9          HG22      ILE   9  -9.217  -0.815   5.126
   74   HG23  ILE   9          HG23      ILE   9 -10.480  -0.906   3.898
   75   HD11  ILE   9          HD11      ILE   9 -13.215  -1.328   3.974
   76   HD12  ILE   9          HD12      ILE   9 -12.540   0.322   3.584
   77   HD13  ILE   9          HD13      ILE   9 -14.144   0.203   4.309
   78    H    PHE  10           H        PHE  10  -8.510   1.703   6.278
   79    HA   PHE  10           HA       PHE  10  -6.565  -0.343   6.139
   80    HB2  PHE  10           HB3      PHE  10  -5.972   1.428   4.804
   81    HB3  PHE  10           HB2      PHE  10  -6.562   2.628   5.948
   82    HD1  PHE  10           HD1      PHE  10  -3.711   1.369   4.467
   83    HD2  PHE  10           HD2      PHE  10  -5.188   2.578   8.271
   84    HE1  PHE  10           HE1      PHE  10  -1.407   1.763   5.233
   85    HE2  PHE  10           HE2      PHE  10  -2.885   2.975   9.045
   86    HZ   PHE  10           HZ       PHE  10  -0.991   2.567   7.524
   87    H    VAL  11           H        VAL  11  -7.416   1.988   8.623
   88    HA   VAL  11           HA       VAL  11  -5.251   1.823  10.302
   89    HB   VAL  11           HB       VAL  11  -8.170   2.076  11.009
   90   HG11  VAL  11          HG11      VAL  11  -5.726   2.265  12.745
   91   HG12  VAL  11          HG12      VAL  11  -7.185   1.308  13.001
   92   HG13  VAL  11          HG13      VAL  11  -7.242   3.063  13.164
   93   HG21  VAL  11          HG21      VAL  11  -6.284   3.847   9.855
   94   HG22  VAL  11          HG22      VAL  11  -6.623   4.416  11.490
   95   HG23  VAL  11          HG23      VAL  11  -7.945   4.182  10.345
   96    H    GLN  12           H        GLN  12  -8.256  -0.405  10.289
   97    HA   GLN  12           HA       GLN  12  -6.949  -2.118  12.317
   98    HB2  GLN  12           HB3      GLN  12  -9.278  -3.322  11.059
   99    HB3  GLN  12           HB2      GLN  12  -9.028  -2.886  12.743
  100    HG2  GLN  12           HG3      GLN  12  -9.424  -0.449  11.599
  101    HG3  GLN  12           HG2      GLN  12 -10.472  -1.481  10.625
  102   HE21  GLN  12          HE21      GLN  12 -12.237  -0.298  11.530
  103   HE22  GLN  12          HE22      GLN  12 -12.831  -0.690  13.105
  104    H    LYS  13           H        LYS  13  -8.020  -2.192   9.137
  105    HA   LYS  13           HA       LYS  13  -7.492  -4.147   7.631
  106    HB2  LYS  13           HB3      LYS  13  -7.097  -1.411   7.402
  107    HB3  LYS  13           HB2      LYS  13  -5.594  -2.127   6.842
  108    HG2  LYS  13           HG3      LYS  13  -8.257  -2.137   5.624
  109    HG3  LYS  13           HG2      LYS  13  -6.661  -2.231   4.877
  110    HD2  LYS  13           HD3      LYS  13  -6.558  -4.617   5.735
  111    HD3  LYS  13           HD2      LYS  13  -8.274  -4.454   6.111
  112    HE2  LYS  13           HE3      LYS  13  -7.000  -5.004   3.595
  113    HE3  LYS  13           HE2      LYS  13  -8.710  -5.060   4.017
  114    HZ1  LYS  13           HZ1      LYS  13  -8.902  -2.726   3.558
  115    HZ2  LYS  13           HZ2      LYS  13  -8.206  -3.484   2.216
  116    HZ3  LYS  13           HZ3      LYS  13  -7.240  -2.588   3.275
  117    H    CYS  14           H        CYS  14  -4.794  -2.479   9.118
  118    HA   CYS  14           HA       CYS  14  -3.060  -4.449   9.526
  119    HB2  CYS  14           HB3      CYS  14  -1.700  -4.917   7.621
  120    HB3  CYS  14           HB2      CYS  14  -3.373  -5.589   7.464
  121    H    ALA  15           H        ALA  15  -3.645  -1.454   9.703
  122    HA   ALA  15           HA       ALA  15  -1.534  -0.116   8.522
  123    HB1  ALA  15           HB1      ALA  15  -2.779   0.730  11.125
  124    HB2  ALA  15           HB2      ALA  15  -3.607   0.871   9.575
  125    HB3  ALA  15           HB3      ALA  15  -2.105   1.752   9.855
  126    H    GLN  16           H        GLN  16  -1.622  -1.904  11.518
  127    HA   GLN  16           HA       GLN  16   0.600  -0.892  12.832
  128    HB2  GLN  16           HB3      GLN  16   0.324  -3.833  12.889
  129    HB3  GLN  16           HB2      GLN  16   0.387  -2.680  14.216
  130    HG2  GLN  16           HG3      GLN  16  -1.981  -2.028  13.546
  131    HG3  GLN  16           HG2      GLN  16  -1.975  -3.488  12.556
  132   HE21  GLN  16          HE21      GLN  16  -0.809  -2.679  15.813
  133   HE22  GLN  16          HE22      GLN  16  -1.624  -3.975  16.611
  134    H    CYS  17           H        CYS  17   0.400  -3.136  10.138
  135    HA   CYS  17           HA       CYS  17   3.201  -3.773  10.151
  136    HB2  CYS  17           HB3      CYS  17   1.361  -4.139   7.798
  137    HB3  CYS  17           HB2      CYS  17   2.762  -5.102   8.257
  138    H    HIS  18           H        HIS  18   1.259  -1.235   8.909
  139    HA   HIS  18           HA       HIS  18   3.464  -0.335   7.182
  140    HB2  HIS  18           HB3      HIS  18   0.556   0.489   7.086
  141    HB3  HIS  18           HB2      HIS  18   1.817   0.995   5.966
  142    HD1  HIS  18           HD1      HIS  18   1.543  -0.188   3.823
  143    HD2  HIS  18           HD2      HIS  18   0.608  -2.627   7.051
  144    HE1  HIS  18           HE1      HIS  18   0.951  -2.420   2.829
  145    H    THR  19           H        THR  19   2.962   0.004  10.161
  146    HA   THR  19           HA       THR  19   3.124   1.609  11.767
  147    HB   THR  19           HB       THR  19   4.574   3.104   9.577
  148    HG1  THR  19           HG1      THR  19   6.402   2.039  10.345
  149   HG21  THR  19          HG21      THR  19   5.022   3.238  12.543
  150   HG22  THR  19          HG22      THR  19   4.097   4.427  11.625
  151   HG23  THR  19          HG23      THR  19   5.812   4.194  11.290
  152    H    VAL  20           H        VAL  20   2.486   3.749  12.465
  153    HA   VAL  20           HA       VAL  20   0.072   4.601  11.119
  154    HB   VAL  20           HB       VAL  20   1.177   5.945  13.559
  155   HG11  VAL  20          HG11      VAL  20  -0.967   6.588  12.226
  156   HG12  VAL  20          HG12      VAL  20  -1.014   6.542  13.990
  157   HG13  VAL  20          HG13      VAL  20  -1.673   5.200  13.055
  158   HG21  VAL  20          HG21      VAL  20   0.176   4.253  14.974
  159   HG22  VAL  20          HG22      VAL  20   1.385   3.515  13.923
  160   HG23  VAL  20          HG23      VAL  20  -0.332   3.332  13.558
  161    H    GLU  21           H        GLU  21   0.605   7.339  12.436
  162    HA   GLU  21           HA       GLU  21   1.310   8.695  10.063
  163    HB2  GLU  21           HB3      GLU  21   1.669  10.305  12.449
  164    HB3  GLU  21           HB2      GLU  21   0.503  10.480  11.145
  165    HG2  GLU  21           HG3      GLU  21  -0.935   8.815  12.212
  166    HG3  GLU  21           HG2      GLU  21   0.231   8.654  13.523
  167    H    LYS  22           H        LYS  22   3.147   9.829   9.492
  168    HA   LYS  22           HA       LYS  22   5.607   8.701  10.025
  169    HB2  LYS  22           HB3      LYS  22   4.909  10.344   8.163
  170    HB3  LYS  22           HB2      LYS  22   5.324  11.609   9.311
  171    HG2  LYS  22           HG3      LYS  22   7.146   9.516   8.154
  172    HG3  LYS  22           HG2      LYS  22   7.199  11.261   7.892
  173    HD2  LYS  22           HD3      LYS  22   7.724   9.823  10.492
  174    HD3  LYS  22           HD2      LYS  22   8.930  10.593   9.459
  175    HE2  LYS  22           HE3      LYS  22   7.984  12.759   9.873
  176    HE3  LYS  22           HE2      LYS  22   6.626  12.048  10.745
  177    HZ1  LYS  22           HZ1      LYS  22   9.114  12.835  11.756
  178    HZ2  LYS  22           HZ2      LYS  22   8.993  11.156  11.939
  179    HZ3  LYS  22           HZ3      LYS  22   7.807  12.166  12.596
  180    H    GLY  23           H        GLY  23   6.839   8.673  11.757
  181    HA2  GLY  23           HA3      GLY  23   7.980  10.542  13.225
  182    HA3  GLY  23           HA2      GLY  23   6.357  10.598  13.902
  183    H    GLY  24           H        GLY  24   5.913   7.731  13.549
  184    HA2  GLY  24           HA3      GLY  24   7.099   6.870  16.030
  185    HA3  GLY  24           HA2      GLY  24   5.997   5.943  15.021
  186    H    LYS  25           H        LYS  25   6.940   4.064  14.565
  187    HA   LYS  25           HA       LYS  25   9.793   4.071  13.838
  188    HB2  LYS  25           HB3      LYS  25   8.645   1.444  14.320
  189    HB3  LYS  25           HB2      LYS  25  10.067   2.194  15.033
  190    HG2  LYS  25           HG3      LYS  25   8.934   2.946  16.850
  191    HG3  LYS  25           HG2      LYS  25   7.420   3.137  15.966
  192    HD2  LYS  25           HD3      LYS  25   8.648   0.536  16.876
  193    HD3  LYS  25           HD2      LYS  25   7.233   1.327  17.574
  194    HE2  LYS  25           HE3      LYS  25   5.914   0.333  16.092
  195    HE3  LYS  25           HE2      LYS  25   6.834   1.041  14.765
  196    HZ1  LYS  25           HZ1      LYS  25   6.885  -1.642  15.802
  197    HZ2  LYS  25           HZ2      LYS  25   8.427  -0.980  15.588
  198    HZ3  LYS  25           HZ3      LYS  25   7.354  -1.061  14.285
  199    H    HIS  26           H        HIS  26  10.476   2.657  12.108
  200    HA   HIS  26           HA       HIS  26   8.880   2.898   9.801
  201    HB2  HIS  26           HB3      HIS  26  10.795   0.811   9.427
  202    HB3  HIS  26           HB2      HIS  26  10.836   2.461   8.815
  203    HD1  HIS  26           HD1      HIS  26  11.571   0.811  12.177
  204    HD2  HIS  26           HD2      HIS  26  13.090   3.699   9.604
  205    HE1  HIS  26           HE1      HIS  26  13.666   1.658  13.280
  206    HE2  HIS  26           HE2      HIS  26  14.516   3.471  11.751
  207    H    LYS  27           H        LYS  27   7.616   1.470   8.694
  208    HA   LYS  27           HA       LYS  27   6.561  -0.751  10.232
  209    HB2  LYS  27           HB3      LYS  27   4.705  -0.653   8.872
  210    HB3  LYS  27           HB2      LYS  27   5.260   1.012   8.780
  211    HG2  LYS  27           HG3      LYS  27   6.613  -0.263   6.729
  212    HG3  LYS  27           HG2      LYS  27   4.995  -0.969   6.694
  213    HD2  LYS  27           HD3      LYS  27   5.432   1.169   5.324
  214    HD3  LYS  27           HD2      LYS  27   3.973   1.090   6.316
  215    HE2  LYS  27           HE3      LYS  27   4.625   2.819   7.560
  216    HE3  LYS  27           HE2      LYS  27   6.226   2.123   7.809
  217    HZ1  LYS  27           HZ1      LYS  27   7.006   3.092   5.820
  218    HZ2  LYS  27           HZ2      LYS  27   6.167   4.316   6.630
  219    HZ3  LYS  27           HZ3      LYS  27   5.449   3.525   5.316
  220    H    THR  28           H        THR  28   5.962  -2.764   8.862
  221    HA   THR  28           HA       THR  28   8.394  -3.983   8.052
  222    HB   THR  28           HB       THR  28   5.781  -5.197   7.297
  223    HG1  THR  28           HG1      THR  28   6.601  -5.208   9.988
  224   HG21  THR  28          HG21      THR  28   6.734  -7.211   7.890
  225   HG22  THR  28          HG22      THR  28   7.916  -6.456   8.959
  226   HG23  THR  28          HG23      THR  28   8.097  -6.322   7.209
  227    H    GLY  29           H        GLY  29   5.623  -2.670   6.303
  228    HA2  GLY  29           HA3      GLY  29   7.231  -2.808   3.839
  229    HA3  GLY  29           HA2      GLY  29   5.567  -3.370   3.830
  230    HA   PRO  30           HA       PRO  30   6.405   1.437   3.049
  231    HB2  PRO  30           HB3      PRO  30   5.341   0.424   0.440
  232    HB3  PRO  30           HB2      PRO  30   6.453   1.763   0.754
  233    HG2  PRO  30           HG3      PRO  30   7.362  -0.589  -0.111
  234    HG3  PRO  30           HG2      PRO  30   8.263   0.355   1.088
  235    HD2  PRO  30           HD3      PRO  30   6.685  -2.133   1.438
  236    HD3  PRO  30           HD2      PRO  30   8.077  -1.536   2.363
  237    H    ASN  31           H        ASN  31   4.751   2.471   3.957
  238    HA   ASN  31           HA       ASN  31   2.201   1.472   4.354
  239    HB2  ASN  31           HB3      ASN  31   3.485   3.595   5.315
  240    HB3  ASN  31           HB2      ASN  31   2.525   4.424   4.095
  241   HD21  ASN  31          HD21      ASN  31   1.845   5.356   6.300
  242   HD22  ASN  31          HD22      ASN  31   0.445   4.636   7.007
  243    H    LEU  32           H        LEU  32   3.076   4.057   2.051
  244    HA   LEU  32           HA       LEU  32   1.601   2.995   0.005
  245    HB2  LEU  32           HB3      LEU  32  -0.296   4.504  -0.258
  246    HB3  LEU  32           HB2      LEU  32  -0.332   3.544   1.211
  247    HG   LEU  32           HG       LEU  32  -1.382   5.673   1.774
  248   HD11  LEU  32          HD11      LEU  32   1.282   5.301   2.715
  249   HD12  LEU  32          HD12      LEU  32  -0.145   4.620   3.494
  250   HD13  LEU  32          HD13      LEU  32   0.122   6.362   3.515
  251   HD21  LEU  32          HD21      LEU  32  -0.609   7.635   1.012
  252   HD22  LEU  32          HD22      LEU  32   0.061   6.559  -0.214
  253   HD23  LEU  32          HD23      LEU  32   1.052   7.077   1.156
  254    H    HIS  33           H        HIS  33   3.078   5.705   1.500
  255    HA   HIS  33           HA       HIS  33   3.147   7.631  -0.455
  256    HB2  HIS  33           HB3      HIS  33   4.463   7.181   1.968
  257    HB3  HIS  33           HB2      HIS  33   5.757   7.365   0.789
  258    HD1  HIS  33           HD1      HIS  33   6.388   9.636   1.926
  259    HD2  HIS  33           HD2      HIS  33   2.602   9.535   0.212
  260    HE1  HIS  33           HE1      HIS  33   5.643  12.035   1.796
  261    HE2  HIS  33           HE2      HIS  33   3.317  11.942   0.835
  262    H    GLY  34           H        GLY  34   3.886   7.713  -2.468
  263    HA2  GLY  34           HA3      GLY  34   5.195   7.321  -4.322
  264    HA3  GLY  34           HA2      GLY  34   6.366   6.546  -3.264
  265    H    LEU  35           H        LEU  35   3.184   5.323  -3.051
  266    HA   LEU  35           HA       LEU  35   3.919   2.727  -3.809
  267    HB2  LEU  35           HB3      LEU  35   1.989   3.321  -2.357
  268    HB3  LEU  35           HB2      LEU  35   1.143   3.914  -3.773
  269    HG   LEU  35           HG       LEU  35   1.086   1.684  -4.730
  270   HD11  LEU  35          HD11      LEU  35   2.258  -0.098  -3.987
  271   HD12  LEU  35          HD12      LEU  35   2.127   0.383  -2.294
  272   HD13  LEU  35          HD13      LEU  35   3.318   1.155  -3.341
  273   HD21  LEU  35          HD21      LEU  35   0.098   2.045  -1.928
  274   HD22  LEU  35          HD22      LEU  35  -0.182   0.533  -2.791
  275   HD23  LEU  35          HD23      LEU  35  -0.806   2.047  -3.442
  276    H    PHE  36           H        PHE  36   2.101   5.215  -5.580
  277    HA   PHE  36           HA       PHE  36   2.469   3.636  -8.035
  278    HB2  PHE  36           HB3      PHE  36   0.581   5.935  -7.974
  279    HB3  PHE  36           HB2      PHE  36   0.458   4.402  -8.829
  280    HD1  PHE  36           HD1      PHE  36  -0.575   2.497  -7.820
  281    HD2  PHE  36           HD2      PHE  36  -0.053   6.100  -5.617
  282    HE1  PHE  36           HE1      PHE  36  -2.109   1.657  -6.090
  283    HE2  PHE  36           HE2      PHE  36  -1.587   5.265  -3.882
  284    HZ   PHE  36           HZ       PHE  36  -2.616   3.041  -4.118
  285    H    GLY  37           H        GLY  37   4.194   5.748  -6.554
  286    HA2  GLY  37           HA3      GLY  37   4.707   7.392  -8.956
  287    HA3  GLY  37           HA2      GLY  37   4.830   8.045  -7.330
  288    H    ARG  38           H        ARG  38   6.113   5.817  -6.125
  289    HA   ARG  38           HA       ARG  38   8.809   6.272  -7.115
  290    HB2  ARG  38           HB3      ARG  38   7.753   4.905  -4.638
  291    HB3  ARG  38           HB2      ARG  38   9.463   5.014  -5.037
  292    HG2  ARG  38           HG3      ARG  38   9.120   7.534  -5.113
  293    HG3  ARG  38           HG2      ARG  38   7.571   7.228  -4.325
  294    HD2  ARG  38           HD3      ARG  38   8.562   6.996  -2.350
  295    HD3  ARG  38           HD2      ARG  38   9.656   5.774  -2.993
  296    HE   ARG  38           HE       ARG  38  11.255   7.373  -2.744
  297   HH11  ARG  38          HH11      ARG  38   8.317   8.918  -3.794
  298   HH12  ARG  38          HH12      ARG  38   9.035  10.489  -3.922
  299   HH21  ARG  38          HH21      ARG  38  12.211   9.438  -2.908
  300   HH22  ARG  38          HH22      ARG  38  11.249  10.784  -3.418
  301    H    LYS  39           H        LYS  39  10.331   4.332  -7.086
  302    HA   LYS  39           HA       LYS  39   9.582   2.533  -9.050
  303    HB2  LYS  39           HB3      LYS  39  11.926   3.014  -8.458
  304    HB3  LYS  39           HB2      LYS  39  11.718   2.131  -6.951
  305    HG2  LYS  39           HG3      LYS  39  12.694   1.078  -9.264
  306    HG3  LYS  39           HG2      LYS  39  12.000   0.141  -7.940
  307    HD2  LYS  39           HD3      LYS  39  11.030  -0.513 -10.081
  308    HD3  LYS  39           HD2      LYS  39   9.811   0.221  -9.036
  309    HE2  LYS  39           HE3      LYS  39  10.379   2.403 -10.255
  310    HE3  LYS  39           HE2      LYS  39  11.161   1.374 -11.451
  311    HZ1  LYS  39           HZ1      LYS  39   9.190   0.566 -12.179
  312    HZ2  LYS  39           HZ2      LYS  39   8.627   2.061 -11.619
  313    HZ3  LYS  39           HZ3      LYS  39   8.438   0.676 -10.666
  314    H    THR  40           H        THR  40  10.715   0.938  -6.176
  315    HA   THR  40           HA       THR  40   8.131  -0.009  -5.372
  316    HB   THR  40           HB       THR  40   8.630  -2.277  -5.145
  317    HG1  THR  40           HG1      THR  40  10.110  -3.472  -6.049
  318   HG21  THR  40          HG21      THR  40   8.308  -2.035  -7.896
  319   HG22  THR  40          HG22      THR  40   8.594  -2.872  -6.685
  320   HG23  THR  40          HG23      THR  40   7.203  -2.890  -6.382
  321    H    GLY  41           H        GLY  41   8.070   0.448  -3.578
  322    HA2  GLY  41           HA3      GLY  41   8.570   0.506  -1.337
  323    HA3  GLY  41           HA2      GLY  41   9.239  -1.096  -1.596
  324    H    GLN  42           H        GLN  42  10.432   1.915  -3.003
  325    HA   GLN  42           HA       GLN  42  12.998   1.414  -1.671
  326    HB2  GLN  42           HB3      GLN  42  13.473   3.440  -3.457
  327    HB3  GLN  42           HB2      GLN  42  13.731   1.730  -3.769
  328    HG2  GLN  42           HG3      GLN  42  12.483   2.879  -5.555
  329    HG3  GLN  42           HG2      GLN  42  11.594   1.540  -4.833
  330   HE21  GLN  42          HE21      GLN  42   9.526   2.035  -4.842
  331   HE22  GLN  42          HE22      GLN  42   8.837   3.541  -4.351
  332    H    ALA  43           H        ALA  43  11.066   2.467  -0.022
  333    HA   ALA  43           HA       ALA  43  10.848   5.222   0.157
  334    HB1  ALA  43           HB1      ALA  43  10.970   4.407   2.792
  335    HB2  ALA  43           HB2      ALA  43  10.445   2.960   1.930
  336    HB3  ALA  43           HB3      ALA  43   9.527   4.458   1.780
  337    HA   PRO  44           HA       PRO  44  14.690   6.748   1.700
  338    HB2  PRO  44           HB3      PRO  44  14.059   8.432   3.685
  339    HB3  PRO  44           HB2      PRO  44  13.548   8.735   2.022
  340    HG2  PRO  44           HG3      PRO  44  11.983   7.597   4.305
  341    HG3  PRO  44           HG2      PRO  44  11.485   8.789   3.092
  342    HD2  PRO  44           HD3      PRO  44  10.857   6.118   2.970
  343    HD3  PRO  44           HD2      PRO  44  10.960   7.179   1.552
  344    H    GLY  45           H        GLY  45  13.793   7.330   4.915
  345    HA2  GLY  45           HA3      GLY  45  15.834   5.625   5.938
  346    HA3  GLY  45           HA2      GLY  45  14.694   6.566   6.890
  347    H    PHE  46           H        PHE  46  13.008   4.697   4.719
  348    HA   PHE  46           HA       PHE  46  12.110   2.920   6.807
  349    HB2  PHE  46           HB3      PHE  46  10.488   3.909   5.261
  350    HB3  PHE  46           HB2      PHE  46  11.287   3.122   3.904
  351    HD1  PHE  46           HD1      PHE  46   9.495   2.422   7.074
  352    HD2  PHE  46           HD2      PHE  46  10.662   0.981   3.247
  353    HE1  PHE  46           HE1      PHE  46   8.060   0.447   7.387
  354    HE2  PHE  46           HE2      PHE  46   9.231  -0.996   3.550
  355    HZ   PHE  46           HZ       PHE  46   7.928  -1.266   5.622
  356    H    THR  47           H        THR  47  12.560   0.796   7.039
  357    HA   THR  47           HA       THR  47  14.751  -0.285   5.512
  358    HB   THR  47           HB       THR  47  13.822  -0.643   8.091
  359    HG1  THR  47           HG1      THR  47  15.529  -2.151   8.199
  360   HG21  THR  47          HG21      THR  47  13.507  -3.115   8.239
  361   HG22  THR  47          HG22      THR  47  13.227  -3.118   6.499
  362   HG23  THR  47          HG23      THR  47  12.141  -2.226   7.566
  363    H    TYR  48           H        TYR  48  14.218  -0.840   3.488
  364    HA   TYR  48           HA       TYR  48  11.717  -2.009   2.770
  365    HB2  TYR  48           HB3      TYR  48  13.647  -2.508   0.747
  366    HB3  TYR  48           HB2      TYR  48  12.370  -1.299   0.756
  367    HD1  TYR  48           HD1      TYR  48  15.814  -1.845   2.098
  368    HD2  TYR  48           HD2      TYR  48  12.966   0.932   0.589
  369    HE1  TYR  48           HE1      TYR  48  17.514  -0.070   2.172
  370    HE2  TYR  48           HE2      TYR  48  14.659   2.714   0.658
  371    HH   TYR  48           HH       TYR  48  17.771   2.236   2.155
  372    H    THR  49           H        THR  49  11.456  -4.074   1.723
  373    HA   THR  49           HA       THR  49  12.743  -6.197   3.190
  374    HB   THR  49           HB       THR  49  11.150  -7.657   2.128
  375    HG1  THR  49           HG1      THR  49   9.698  -6.628   0.525
  376   HG21  THR  49          HG21      THR  49   9.230  -5.508   2.264
  377   HG22  THR  49          HG22      THR  49  10.336  -5.491   3.636
  378   HG23  THR  49          HG23      THR  49   9.400  -6.942   3.277
  379    H    ASP  50           H        ASP  50  13.423  -8.201   1.828
  380    HA   ASP  50           HA       ASP  50  15.685  -7.542   0.369
  381    HB2  ASP  50           HB3      ASP  50  15.737  -9.740   1.069
  382    HB3  ASP  50           HB2      ASP  50  14.046 -10.019   0.664
  383    H    ALA  51           H        ALA  51  12.379  -8.061  -0.698
  384    HA   ALA  51           HA       ALA  51  12.944  -8.044  -3.489
  385    HB1  ALA  51           HB1      ALA  51  10.826  -8.695  -3.591
  386    HB2  ALA  51           HB2      ALA  51  10.290  -7.134  -2.970
  387    HB3  ALA  51           HB3      ALA  51  10.679  -8.443  -1.853
  388    H    ASN  52           H        ASN  52  11.831  -5.560  -1.201
  389    HA   ASN  52           HA       ASN  52  11.500  -3.486  -3.060
  390    HB2  ASN  52           HB3      ASN  52  12.227  -3.356  -0.126
  391    HB3  ASN  52           HB2      ASN  52  11.726  -1.971  -1.093
  392   HD21  ASN  52          HD21      ASN  52   9.949  -4.087  -2.521
  393   HD22  ASN  52          HD22      ASN  52   8.548  -4.141  -1.511
  394    H    LYS  53           H        LYS  53  14.308  -4.438  -1.120
  395    HA   LYS  53           HA       LYS  53  16.022  -2.361  -1.876
  396    HB2  LYS  53           HB3      LYS  53  17.855  -4.033  -1.332
  397    HB3  LYS  53           HB2      LYS  53  16.691  -3.720  -0.052
  398    HG2  LYS  53           HG3      LYS  53  15.574  -5.784  -0.459
  399    HG3  LYS  53           HG2      LYS  53  16.517  -6.067  -1.923
  400    HD2  LYS  53           HD3      LYS  53  17.675  -7.383  -0.456
  401    HD3  LYS  53           HD2      LYS  53  18.541  -5.862  -0.238
  402    HE2  LYS  53           HE3      LYS  53  18.036  -5.899   1.922
  403    HE3  LYS  53           HE2      LYS  53  16.323  -5.821   1.512
  404    HZ1  LYS  53           HZ1      LYS  53  17.851  -8.023   2.500
  405    HZ2  LYS  53           HZ2      LYS  53  17.003  -8.433   1.096
  406    HZ3  LYS  53           HZ3      LYS  53  16.173  -7.820   2.437
  407    H    ASN  54           H        ASN  54  15.067  -5.301  -3.482
  408    HA   ASN  54           HA       ASN  54  17.102  -5.194  -5.503
  409    HB2  ASN  54           HB3      ASN  54  14.480  -6.710  -5.452
  410    HB3  ASN  54           HB2      ASN  54  15.791  -6.969  -6.599
  411   HD21  ASN  54          HD21      ASN  54  17.147  -6.168  -3.714
  412   HD22  ASN  54          HD22      ASN  54  17.437  -7.751  -3.084
  413    H    LYS  55           H        LYS  55  14.162  -3.595  -4.934
  414    HA   LYS  55           HA       LYS  55  13.114  -1.926  -6.081
  415    HB2  LYS  55           HB3      LYS  55  15.408  -2.394  -7.975
  416    HB3  LYS  55           HB2      LYS  55  14.127  -1.247  -8.336
  417    HG2  LYS  55           HG3      LYS  55  14.933   0.281  -6.922
  418    HG3  LYS  55           HG2      LYS  55  15.281  -0.917  -5.674
  419    HD2  LYS  55           HD3      LYS  55  16.973  -0.121  -8.029
  420    HD3  LYS  55           HD2      LYS  55  17.376  -0.044  -6.311
  421    HE2  LYS  55           HE3      LYS  55  17.009  -2.632  -6.422
  422    HE3  LYS  55           HE2      LYS  55  17.297  -2.398  -8.145
  423    HZ1  LYS  55           HZ1      LYS  55  19.383  -2.849  -7.252
  424    HZ2  LYS  55           HZ2      LYS  55  19.134  -1.879  -5.889
  425    HZ3  LYS  55           HZ3      LYS  55  19.377  -1.164  -7.403
  426    H    GLY  56           H        GLY  56  11.674  -3.992  -6.098
  427    HA2  GLY  56           HA3      GLY  56  11.255  -5.515  -8.374
  428    HA3  GLY  56           HA2      GLY  56  10.004  -5.097  -7.215
  429    H    ILE  57           H        ILE  57   8.410  -3.746  -7.837
  430    HA   ILE  57           HA       ILE  57   8.874  -1.951 -10.062
  431    HB   ILE  57           HB       ILE  57   7.749  -4.379 -10.627
  432   HG12  ILE  57          HG13      ILE  57   8.607  -3.263 -12.405
  433   HG13  ILE  57          HG12      ILE  57   6.901  -2.934 -12.691
  434   HG21  ILE  57          HG21      ILE  57   5.666  -4.033  -9.613
  435   HG22  ILE  57          HG22      ILE  57   5.404  -3.685 -11.321
  436   HG23  ILE  57          HG23      ILE  57   5.585  -2.362 -10.171
  437   HD11  ILE  57          HD11      ILE  57   7.107  -0.748 -12.174
  438   HD12  ILE  57          HD12      ILE  57   8.769  -1.044 -12.690
  439   HD13  ILE  57          HD13      ILE  57   8.364  -1.039 -10.971
  440    H    THR  58           H        THR  58   6.872  -0.594 -10.515
  441    HA   THR  58           HA       THR  58   5.992   0.496  -8.008
  442    HB   THR  58           HB       THR  58   6.418   1.484 -10.600
  443    HG1  THR  58           HG1      THR  58   5.920   3.469  -9.563
  444   HG21  THR  58          HG21      THR  58   4.065   0.930 -11.121
  445   HG22  THR  58          HG22      THR  58   4.416   2.657 -11.177
  446   HG23  THR  58          HG23      THR  58   3.564   1.976  -9.792
  447    H    TRP  59           H        TRP  59   4.337  -0.277  -6.971
  448    HA   TRP  59           HA       TRP  59   2.397  -2.016  -8.072
  449    HB2  TRP  59           HB3      TRP  59   1.720  -0.586  -5.573
  450    HB3  TRP  59           HB2      TRP  59   1.724  -2.313  -5.920
  451    HD1  TRP  59           HD1      TRP  59   4.150   0.525  -4.952
  452    HE1  TRP  59           HE1      TRP  59   6.213  -0.527  -3.828
  453    HE3  TRP  59           HE3      TRP  59   3.026  -4.416  -5.644
  454    HZ2  TRP  59           HZ2      TRP  59   7.228  -3.106  -3.300
  455    HZ3  TRP  59           HZ3      TRP  59   4.596  -6.112  -4.799
  456    HH2  TRP  59           HH2      TRP  59   6.653  -5.470  -3.651
  457    H    LYS  60           H        LYS  60   0.973  -1.371  -9.533
  458    HA   LYS  60           HA       LYS  60  -0.271   1.274  -9.271
  459    HB2  LYS  60           HB3      LYS  60   0.050   1.388 -11.478
  460    HB3  LYS  60           HB2      LYS  60   0.666  -0.258 -11.500
  461    HG2  LYS  60           HG3      LYS  60  -1.067  -0.611 -12.876
  462    HG3  LYS  60           HG2      LYS  60  -1.985  -0.741 -11.376
  463    HD2  LYS  60           HD3      LYS  60  -3.113   1.155 -11.771
  464    HD3  LYS  60           HD2      LYS  60  -1.664   2.007 -12.315
  465    HE2  LYS  60           HE3      LYS  60  -2.312   0.052 -14.264
  466    HE3  LYS  60           HE2      LYS  60  -3.791   0.925 -13.868
  467    HZ1  LYS  60           HZ1      LYS  60  -1.876   1.761 -15.596
  468    HZ2  LYS  60           HZ2      LYS  60  -1.517   2.645 -14.201
  469    HZ3  LYS  60           HZ3      LYS  60  -3.057   2.747 -14.892
  470    H    GLU  61           H        GLU  61  -2.627   1.292 -10.108
  471    HA   GLU  61           HA       GLU  61  -4.194  -0.203  -8.327
  472    HB2  GLU  61           HB3      GLU  61  -4.600   1.959 -10.012
  473    HB3  GLU  61           HB2      GLU  61  -5.653   0.717 -10.677
  474    HG2  GLU  61           HG3      GLU  61  -5.935   0.744  -7.843
  475    HG3  GLU  61           HG2      GLU  61  -6.101   2.390  -8.455
  476    H    GLU  62           H        GLU  62  -3.985  -0.483 -11.881
  477    HA   GLU  62           HA       GLU  62  -5.556  -2.807 -12.071
  478    HB2  GLU  62           HB3      GLU  62  -5.074  -2.779 -14.319
  479    HB3  GLU  62           HB2      GLU  62  -4.721  -1.111 -13.893
  480    HG2  GLU  62           HG3      GLU  62  -2.332  -1.715 -13.686
  481    HG3  GLU  62           HG2      GLU  62  -2.731  -3.338 -14.247
  482    H    THR  63           H        THR  63  -2.043  -2.378 -11.857
  483    HA   THR  63           HA       THR  63  -1.354  -5.088 -12.192
  484    HB   THR  63           HB       THR  63   0.006  -2.659 -11.737
  485    HG1  THR  63           HG1      THR  63   1.330  -3.717 -12.950
  486   HG21  THR  63          HG21      THR  63   1.512  -2.958 -10.033
  487   HG22  THR  63          HG22      THR  63   1.228  -4.697  -9.942
  488   HG23  THR  63          HG23      THR  63   0.027  -3.574  -9.310
  489    H    LEU  64           H        LEU  64  -2.474  -3.261  -9.465
  490    HA   LEU  64           HA       LEU  64  -1.703  -5.123  -7.449
  491    HB2  LEU  64           HB3      LEU  64  -3.187  -2.616  -7.617
  492    HB3  LEU  64           HB2      LEU  64  -3.875  -3.728  -6.448
  493    HG   LEU  64           HG       LEU  64  -1.036  -2.701  -6.476
  494   HD11  LEU  64          HD11      LEU  64  -2.132  -0.944  -5.562
  495   HD12  LEU  64          HD12      LEU  64  -2.031  -1.949  -4.117
  496   HD13  LEU  64          HD13      LEU  64  -3.515  -1.920  -5.067
  497   HD21  LEU  64          HD21      LEU  64  -0.721  -3.918  -4.421
  498   HD22  LEU  64          HD22      LEU  64  -1.222  -5.039  -5.686
  499   HD23  LEU  64          HD23      LEU  64  -2.384  -4.507  -4.472
  500    H    MET  65           H        MET  65  -4.531  -4.661  -9.473
  501    HA   MET  65           HA       MET  65  -6.316  -6.354  -8.130
  502    HB2  MET  65           HB3      MET  65  -6.069  -5.584 -11.036
  503    HB3  MET  65           HB2      MET  65  -7.371  -6.605 -10.440
  504    HG2  MET  65           HG3      MET  65  -6.793  -3.747  -9.723
  505    HG3  MET  65           HG2      MET  65  -8.203  -4.392 -10.565
  506    HE1  MET  65           HE1      MET  65  -6.706  -3.241  -7.382
  507    HE2  MET  65           HE2      MET  65  -6.240  -4.915  -7.081
  508    HE3  MET  65           HE3      MET  65  -7.477  -4.147  -6.083
  509    H    GLU  66           H        GLU  66  -3.916  -7.018 -10.641
  510    HA   GLU  66           HA       GLU  66  -4.546  -9.823 -10.754
  511    HB2  GLU  66           HB3      GLU  66  -2.322  -9.858 -12.070
  512    HB3  GLU  66           HB2      GLU  66  -3.692  -9.009 -12.771
  513    HG2  GLU  66           HG3      GLU  66  -2.796  -6.887 -12.058
  514    HG3  GLU  66           HG2      GLU  66  -1.465  -7.697 -11.230
  515    H    TYR  67           H        TYR  67  -2.149  -7.785  -9.193
  516    HA   TYR  67           HA       TYR  67  -0.422  -9.795  -8.265
  517    HB2  TYR  67           HB3      TYR  67   0.559  -7.752  -7.983
  518    HB3  TYR  67           HB2      TYR  67  -0.963  -6.959  -7.592
  519    HD1  TYR  67           HD1      TYR  67   1.962  -8.659  -6.266
  520    HD2  TYR  67           HD2      TYR  67  -1.853  -7.048  -5.292
  521    HE1  TYR  67           HE1      TYR  67   2.564  -8.691  -3.882
  522    HE2  TYR  67           HE2      TYR  67  -1.261  -7.074  -2.904
  523    HH   TYR  67           HH       TYR  67   0.573  -7.182  -1.462
  524    H    LEU  68           H        LEU  68  -3.554  -8.800  -7.235
  525    HA   LEU  68           HA       LEU  68  -3.498  -9.628  -4.552
  526    HB2  LEU  68           HB3      LEU  68  -5.688  -9.321  -6.580
  527    HB3  LEU  68           HB2      LEU  68  -6.031  -9.974  -4.989
  528    HG   LEU  68           HG       LEU  68  -4.769  -7.275  -5.464
  529   HD11  LEU  68          HD11      LEU  68  -6.898  -6.290  -5.068
  530   HD12  LEU  68          HD12      LEU  68  -7.622  -7.857  -4.699
  531   HD13  LEU  68          HD13      LEU  68  -7.104  -7.491  -6.344
  532   HD21  LEU  68          HD21      LEU  68  -4.228  -8.216  -3.302
  533   HD22  LEU  68          HD22      LEU  68  -5.929  -8.574  -3.003
  534   HD23  LEU  68          HD23      LEU  68  -5.384  -6.900  -3.110
  535    H    GLU  69           H        GLU  69  -3.375 -11.425  -7.435
  536    HA   GLU  69           HA       GLU  69  -4.690 -13.790  -6.701
  537    HB2  GLU  69           HB3      GLU  69  -3.329 -12.903  -8.921
  538    HB3  GLU  69           HB2      GLU  69  -2.274 -14.175  -8.317
  539    HG2  GLU  69           HG3      GLU  69  -4.119 -15.756  -8.380
  540    HG3  GLU  69           HG2      GLU  69  -5.203 -14.485  -8.940
  541    H    ASN  70           H        ASN  70  -1.166 -13.671  -7.039
  542    HA   ASN  70           HA       ASN  70  -0.957 -15.184  -4.519
  543    HB2  ASN  70           HB3      ASN  70   0.436 -15.510  -7.149
  544    HB3  ASN  70           HB2      ASN  70   1.272 -15.976  -5.669
  545   HD21  ASN  70          HD21      ASN  70  -1.076 -16.821  -7.978
  546   HD22  ASN  70          HD22      ASN  70  -1.591 -18.305  -7.258
  547    HA   PRO  71           HA       PRO  71   1.057 -11.173  -3.552
  548    HB2  PRO  71           HB3      PRO  71   1.063 -12.618  -0.942
  549    HB3  PRO  71           HB2      PRO  71   0.625 -10.943  -1.301
  550    HG2  PRO  71           HG3      PRO  71  -1.257 -12.763  -0.827
  551    HG3  PRO  71           HG2      PRO  71  -1.484 -11.518  -2.069
  552    HD2  PRO  71           HD3      PRO  71  -0.841 -14.414  -2.380
  553    HD3  PRO  71           HD2      PRO  71  -1.831 -13.358  -3.411
  554    H    LYS  72           H        LYS  72   2.014 -14.469  -2.749
  555    HA   LYS  72           HA       LYS  72   4.730 -13.743  -2.139
  556    HB2  LYS  72           HB3      LYS  72   4.739 -15.752  -1.168
  557    HB3  LYS  72           HB2      LYS  72   3.088 -15.994  -1.721
  558    HG2  LYS  72           HG3      LYS  72   4.092 -17.841  -2.603
  559    HG3  LYS  72           HG2      LYS  72   4.279 -16.713  -3.947
  560    HD2  LYS  72           HD3      LYS  72   6.478 -16.401  -2.149
  561    HD3  LYS  72           HD2      LYS  72   6.295 -18.111  -2.547
  562    HE2  LYS  72           HE3      LYS  72   5.945 -16.691  -4.949
  563    HE3  LYS  72           HE2      LYS  72   7.345 -15.978  -4.148
  564    HZ1  LYS  72           HZ1      LYS  72   8.334 -18.163  -3.976
  565    HZ2  LYS  72           HZ2      LYS  72   7.960 -17.828  -5.591
  566    HZ3  LYS  72           HZ3      LYS  72   6.978 -18.874  -4.697
  567    H    LYS  73           H        LYS  73   2.932 -14.606  -4.951
  568    HA   LYS  73           HA       LYS  73   5.094 -15.549  -6.539
  569    HB2  LYS  73           HB3      LYS  73   3.577 -15.673  -8.277
  570    HB3  LYS  73           HB2      LYS  73   2.508 -15.766  -6.884
  571    HG2  LYS  73           HG3      LYS  73   1.372 -14.186  -8.009
  572    HG3  LYS  73           HG2      LYS  73   2.543 -13.107  -7.247
  573    HD2  LYS  73           HD3      LYS  73   2.159 -12.864  -9.771
  574    HD3  LYS  73           HD2      LYS  73   3.828 -12.936  -9.196
  575    HE2  LYS  73           HE3      LYS  73   3.300 -14.337 -11.228
  576    HE3  LYS  73           HE2      LYS  73   4.068 -15.185  -9.884
  577    HZ1  LYS  73           HZ1      LYS  73   1.736 -15.827  -9.205
  578    HZ2  LYS  73           HZ2      LYS  73   2.337 -16.566 -10.604
  579    HZ3  LYS  73           HZ3      LYS  73   1.233 -15.289 -10.729
  580    H    TYR  74           H        TYR  74   3.814 -12.390  -5.793
  581    HA   TYR  74           HA       TYR  74   5.301 -11.063  -7.880
  582    HB2  TYR  74           HB3      TYR  74   3.363 -10.271  -5.789
  583    HB3  TYR  74           HB2      TYR  74   4.546  -9.046  -6.241
  584    HD1  TYR  74           HD1      TYR  74   2.051 -11.384  -7.725
  585    HD2  TYR  74           HD2      TYR  74   4.178  -7.721  -8.119
  586    HE1  TYR  74           HE1      TYR  74   0.702 -10.820  -9.702
  587    HE2  TYR  74           HE2      TYR  74   2.834  -7.146 -10.096
  588    HH   TYR  74           HH       TYR  74   0.600  -9.435 -11.528
  589    H    ILE  75           H        ILE  75   5.534 -11.401  -4.358
  590    HA   ILE  75           HA       ILE  75   8.357 -10.603  -4.556
  591    HB   ILE  75           HB       ILE  75   6.343  -9.622  -2.544
  592   HG12  ILE  75          HG13      ILE  75   6.397  -8.117  -4.325
  593   HG13  ILE  75          HG12      ILE  75   7.572  -7.428  -3.211
  594   HG21  ILE  75          HG21      ILE  75   8.357  -8.540  -1.444
  595   HG22  ILE  75          HG22      ILE  75   9.342  -9.681  -2.360
  596   HG23  ILE  75          HG23      ILE  75   8.160 -10.274  -1.194
  597   HD11  ILE  75          HD11      ILE  75   8.881  -7.331  -5.016
  598   HD12  ILE  75          HD12      ILE  75   7.937  -8.540  -5.889
  599   HD13  ILE  75          HD13      ILE  75   9.147  -9.048  -4.711
  600    HA   PRO  76           HA       PRO  76   7.890 -14.780  -2.558
  601    HB2  PRO  76           HB3      PRO  76  10.592 -14.985  -3.764
  602    HB3  PRO  76           HB2      PRO  76   9.248 -16.130  -3.815
  603    HG2  PRO  76           HG3      PRO  76   9.898 -14.682  -5.960
  604    HG3  PRO  76           HG2      PRO  76   8.203 -15.029  -5.567
  605    HD2  PRO  76           HD3      PRO  76   9.769 -12.513  -5.163
  606    HD3  PRO  76           HD2      PRO  76   8.079 -12.721  -5.667
  607    H    GLY  77           H        GLY  77   8.543 -15.179  -0.531
  608    HA2  GLY  77           HA3      GLY  77  10.296 -15.369   1.114
  609    HA3  GLY  77           HA2      GLY  77  11.055 -13.955   0.401
  610    H    THR  78           H        THR  78   8.179 -12.806   0.275
  611    HA   THR  78           HA       THR  78   8.273 -11.711   2.994
  612    HB   THR  78           HB       THR  78   8.077 -10.455   0.556
  613    HG1  THR  78           HG1      THR  78   7.099  -9.426   3.008
  614   HG21  THR  78          HG21      THR  78   5.645 -11.261   0.528
  615   HG22  THR  78          HG22      THR  78   5.969  -9.555   0.216
  616   HG23  THR  78          HG23      THR  78   5.387 -10.067   1.800
  617    H    LYS  79           H        LYS  79   6.763 -12.175   4.449
  618    HA   LYS  79           HA       LYS  79   4.363 -13.615   3.547
  619    HB2  LYS  79           HB3      LYS  79   6.093 -14.603   5.240
  620    HB3  LYS  79           HB2      LYS  79   5.284 -13.554   6.398
  621    HG2  LYS  79           HG3      LYS  79   4.517 -16.014   6.131
  622    HG3  LYS  79           HG2      LYS  79   3.312 -14.736   6.302
  623    HD2  LYS  79           HD3      LYS  79   2.785 -16.378   4.509
  624    HD3  LYS  79           HD2      LYS  79   2.915 -14.713   3.933
  625    HE2  LYS  79           HE3      LYS  79   4.029 -16.368   2.456
  626    HE3  LYS  79           HE2      LYS  79   5.115 -15.122   3.068
  627    HZ1  LYS  79           HZ1      LYS  79   6.038 -17.406   3.144
  628    HZ2  LYS  79           HZ2      LYS  79   4.851 -17.820   4.274
  629    HZ3  LYS  79           HZ3      LYS  79   6.003 -16.641   4.653
  630    H    MET  80           H        MET  80   2.341 -12.927   4.116
  631    HA   MET  80           HA       MET  80   2.200 -10.271   5.369
  632    HB2  MET  80           HB3      MET  80   0.520 -11.689   3.340
  633    HB3  MET  80           HB2      MET  80  -0.222 -10.454   4.347
  634    HG2  MET  80           HG3      MET  80   2.292  -9.916   2.813
  635    HG3  MET  80           HG2      MET  80   0.702  -9.767   2.067
  636    HE1  MET  80           HE1      MET  80  -0.596  -8.173   2.002
  637    HE2  MET  80           HE2      MET  80  -0.050  -6.519   2.277
  638    HE3  MET  80           HE3      MET  80  -1.153  -7.286   3.420
  639    H    ILE  81           H        ILE  81   1.736 -10.342   7.060
  640    HA   ILE  81           HA       ILE  81  -0.082 -12.433   8.448
  641    HB   ILE  81           HB       ILE  81   1.821 -10.723  10.051
  642   HG12  ILE  81          HG13      ILE  81   3.001 -13.014  10.288
  643   HG13  ILE  81          HG12      ILE  81   2.089 -13.469   8.851
  644   HG21  ILE  81          HG21      ILE  81   0.005 -11.436  11.414
  645   HG22  ILE  81          HG22      ILE  81   1.387 -12.462  11.798
  646   HG23  ILE  81          HG23      ILE  81   0.090 -13.077  10.771
  647   HD11  ILE  81          HD11      ILE  81   3.249 -11.009   8.238
  648   HD12  ILE  81          HD12      ILE  81   3.722 -12.601   7.642
  649   HD13  ILE  81          HD13      ILE  81   4.498 -11.928   9.077
  650    H    PHE  82           H        PHE  82  -2.022 -11.903   9.242
  651    HA   PHE  82           HA       PHE  82  -3.524 -10.579  10.481
  652    HB2  PHE  82           HB3      PHE  82  -1.426  -8.963  10.748
  653    HB3  PHE  82           HB2      PHE  82  -2.299  -8.033   9.538
  654    HD1  PHE  82           HD1      PHE  82  -3.885  -6.511  10.226
  655    HD2  PHE  82           HD2      PHE  82  -2.839  -9.726  12.811
  656    HE1  PHE  82           HE1      PHE  82  -5.306  -5.551  11.989
  657    HE2  PHE  82           HE2      PHE  82  -4.261  -8.772  14.579
  658    HZ   PHE  82           HZ       PHE  82  -5.496  -6.682  14.169
  659    H    ALA  83           H        ALA  83  -5.132  -8.783   9.768
  660    HA   ALA  83           HA       ALA  83  -5.736  -7.647   7.535
  661    HB1  ALA  83           HB1      ALA  83  -6.692  -9.609   6.050
  662    HB2  ALA  83           HB2      ALA  83  -5.430 -10.525   6.870
  663    HB3  ALA  83           HB3      ALA  83  -5.010  -9.096   5.927
  664    H    GLY  84           H        GLY  84  -7.243  -6.945   9.119
  665    HA2  GLY  84           HA3      GLY  84  -9.359  -8.687   9.993
  666    HA3  GLY  84           HA2      GLY  84  -9.232  -6.961  10.299
  667    H    ILE  85           H        ILE  85  -9.113  -8.389   7.098
  668    HA   ILE  85           HA       ILE  85 -11.831  -7.394   6.573
  669    HB   ILE  85           HB       ILE  85  -9.416  -6.943   4.819
  670   HG12  ILE  85          HG13      ILE  85  -9.612  -5.393   6.730
  671   HG13  ILE  85          HG12      ILE  85  -9.866  -4.571   5.195
  672   HG21  ILE  85          HG21      ILE  85 -11.882  -7.468   3.883
  673   HG22  ILE  85          HG22      ILE  85 -10.744  -6.383   3.085
  674   HG23  ILE  85          HG23      ILE  85 -12.008  -5.725   4.124
  675   HD11  ILE  85          HD11      ILE  85 -12.270  -4.621   5.557
  676   HD12  ILE  85          HD12      ILE  85 -11.438  -3.817   6.887
  677   HD13  ILE  85          HD13      ILE  85 -12.027  -5.467   7.086
  678    H    LYS  86           H        LYS  86 -13.089  -8.878   5.673
  679    HA   LYS  86           HA       LYS  86 -11.825 -11.053   4.145
  680    HB2  LYS  86           HB3      LYS  86 -13.779 -12.466   4.974
  681    HB3  LYS  86           HB2      LYS  86 -12.528 -12.081   6.149
  682    HG2  LYS  86           HG3      LYS  86 -13.883 -10.479   7.218
  683    HG3  LYS  86           HG2      LYS  86 -15.048 -10.468   5.892
  684    HD2  LYS  86           HD3      LYS  86 -15.369 -12.968   6.463
  685    HD3  LYS  86           HD2      LYS  86 -14.592 -12.559   7.993
  686    HE2  LYS  86           HE3      LYS  86 -16.494 -11.717   8.771
  687    HE3  LYS  86           HE2      LYS  86 -16.596 -10.610   7.404
  688    HZ1  LYS  86           HZ1      LYS  86 -18.528 -11.857   7.254
  689    HZ2  LYS  86           HZ2      LYS  86 -17.766 -13.305   7.686
  690    HZ3  LYS  86           HZ3      LYS  86 -17.502 -12.636   6.155
  691    H    LYS  87           H        LYS  87 -12.569  -8.858   2.800
  692    HA   LYS  87           HA       LYS  87 -14.631  -9.880   1.074
  693    HB2  LYS  87           HB3      LYS  87 -15.105  -7.543   2.869
  694    HB3  LYS  87           HB2      LYS  87 -15.768  -7.497   1.241
  695    HG2  LYS  87           HG3      LYS  87 -17.100  -9.410   1.627
  696    HG3  LYS  87           HG2      LYS  87 -16.255  -9.778   3.131
  697    HD2  LYS  87           HD3      LYS  87 -17.302  -8.065   4.289
  698    HD3  LYS  87           HD2      LYS  87 -17.682  -7.168   2.817
  699    HE2  LYS  87           HE3      LYS  87 -19.221  -9.111   2.229
  700    HE3  LYS  87           HE2      LYS  87 -19.014  -9.637   3.898
  701    HZ1  LYS  87           HZ1      LYS  87 -19.859  -7.475   4.623
  702    HZ2  LYS  87           HZ2      LYS  87 -20.993  -8.302   3.677
  703    HZ3  LYS  87           HZ3      LYS  87 -20.108  -7.022   3.012
  704    H    LYS  88           H        LYS  88 -13.800  -9.614  -0.878
  705    HA   LYS  88           HA       LYS  88 -11.602  -8.110  -1.561
  706    HB2  LYS  88           HB3      LYS  88 -11.907  -9.068  -3.557
  707    HB3  LYS  88           HB2      LYS  88 -13.370  -9.789  -2.899
  708    HG2  LYS  88           HG3      LYS  88 -13.437  -7.048  -4.089
  709    HG3  LYS  88           HG2      LYS  88 -13.492  -8.480  -5.119
  710    HD2  LYS  88           HD3      LYS  88 -15.364  -9.174  -3.346
  711    HD3  LYS  88           HD2      LYS  88 -15.506  -7.420  -3.221
  712    HE2  LYS  88           HE3      LYS  88 -15.907  -7.239  -5.592
  713    HE3  LYS  88           HE2      LYS  88 -15.612  -8.964  -5.808
  714    HZ1  LYS  88           HZ1      LYS  88 -18.035  -7.806  -5.402
  715    HZ2  LYS  88           HZ2      LYS  88 -17.653  -8.416  -3.870
  716    HZ3  LYS  88           HZ3      LYS  88 -17.685  -9.450  -5.207
  717    H    THR  89           H        THR  89 -14.994  -7.153  -1.576
  718    HA   THR  89           HA       THR  89 -14.683  -4.688  -2.897
  719    HB   THR  89           HB       THR  89 -16.838  -5.994  -2.302
  720    HG1  THR  89           HG1      THR  89 -17.196  -4.161  -3.360
  721   HG21  THR  89          HG21      THR  89 -17.187  -4.140  -0.044
  722   HG22  THR  89          HG22      THR  89 -16.196  -5.567   0.259
  723   HG23  THR  89          HG23      THR  89 -17.855  -5.749  -0.314
  724    H    GLU  90           H        GLU  90 -13.976  -5.688   0.332
  725    HA   GLU  90           HA       GLU  90 -13.971  -3.076   1.504
  726    HB2  GLU  90           HB3      GLU  90 -12.651  -5.631   2.445
  727    HB3  GLU  90           HB2      GLU  90 -12.858  -4.172   3.407
  728    HG2  GLU  90           HG3      GLU  90 -15.225  -5.550   2.214
  729    HG3  GLU  90           HG2      GLU  90 -14.501  -6.135   3.711
  730    H    ARG  91           H        ARG  91 -11.487  -5.296   0.321
  731    HA   ARG  91           HA       ARG  91  -9.279  -3.613   0.849
  732    HB2  ARG  91           HB3      ARG  91  -9.719  -6.014  -1.043
  733    HB3  ARG  91           HB2      ARG  91  -8.162  -5.083  -0.878
  734    HG2  ARG  91           HG3      ARG  91  -8.601  -5.690   1.717
  735    HG3  ARG  91           HG2      ARG  91  -9.392  -7.062   0.915
  736    HD2  ARG  91           HD3      ARG  91  -6.754  -6.868  -0.374
  737    HD3  ARG  91           HD2      ARG  91  -6.646  -6.589   1.368
  738    HE   ARG  91           HE       ARG  91  -7.971  -8.710   1.410
  739   HH11  ARG  91          HH11      ARG  91  -5.583  -7.773  -0.947
  740   HH12  ARG  91          HH12      ARG  91  -5.041  -9.325  -1.213
  741   HH21  ARG  91          HH21      ARG  91  -7.282 -10.852   1.020
  742   HH22  ARG  91          HH22      ARG  91  -6.022 -11.155  -0.114
  743    H    GLU  92           H        GLU  92 -11.207  -4.184  -2.074
  744    HA   GLU  92           HA       GLU  92  -9.755  -2.586  -3.833
  745    HB2  GLU  92           HB3      GLU  92 -12.755  -2.925  -3.858
  746    HB3  GLU  92           HB2      GLU  92 -11.713  -2.558  -5.226
  747    HG2  GLU  92           HG3      GLU  92 -12.436  -5.110  -4.078
  748    HG3  GLU  92           HG2      GLU  92 -11.738  -4.734  -5.651
  749    H    ASP  93           H        ASP  93 -12.260  -1.726  -1.512
  750    HA   ASP  93           HA       ASP  93 -12.731   0.903  -2.335
  751    HB2  ASP  93           HB3      ASP  93 -13.679  -0.704  -0.326
  752    HB3  ASP  93           HB2      ASP  93 -12.759   0.495   0.576
  753    H    GLY  94           H        GLY  94 -10.379  -0.371   0.006
  754    HA2  GLY  94           HA3      GLY  94  -9.274   2.066   0.813
  755    HA3  GLY  94           HA2      GLY  94  -8.430   0.523   0.825
  756    H    ILE  95           H        ILE  95  -8.645   0.111  -2.035
  757    HA   ILE  95           HA       ILE  95  -6.259   1.299  -2.874
  758    HB   ILE  95           HB       ILE  95  -8.436   0.274  -4.691
  759   HG12  ILE  95          HG13      ILE  95  -6.812  -1.109  -2.726
  760   HG13  ILE  95          HG12      ILE  95  -8.160  -1.713  -3.684
  761   HG21  ILE  95          HG21      ILE  95  -6.852   0.101  -6.345
  762   HG22  ILE  95          HG22      ILE  95  -5.512   0.025  -5.203
  763   HG23  ILE  95          HG23      ILE  95  -6.318   1.562  -5.513
  764   HD11  ILE  95          HD11      ILE  95  -6.358  -3.069  -4.264
  765   HD12  ILE  95          HD12      ILE  95  -5.242  -1.705  -4.350
  766   HD13  ILE  95          HD13      ILE  95  -6.480  -1.913  -5.590
  767    H    ALA  96           H        ALA  96  -9.629   2.163  -3.592
  768    HA   ALA  96           HA       ALA  96  -9.148   4.234  -5.391
  769    HB1  ALA  96           HB1      ALA  96 -11.391   4.175  -3.379
  770    HB2  ALA  96           HB2      ALA  96 -11.371   3.209  -4.855
  771    HB3  ALA  96           HB3      ALA  96 -11.375   4.969  -4.955
  772    H    TYR  97           H        TYR  97  -9.298   4.259  -1.860
  773    HA   TYR  97           HA       TYR  97  -9.017   7.058  -1.547
  774    HB2  TYR  97           HB3      TYR  97  -9.852   5.807   0.307
  775    HB3  TYR  97           HB2      TYR  97  -8.455   4.738   0.302
  776    HD1  TYR  97           HD1      TYR  97  -9.920   7.513   1.862
  777    HD2  TYR  97           HD2      TYR  97  -6.139   5.973   0.674
  778    HE1  TYR  97           HE1      TYR  97  -8.817   8.961   3.516
  779    HE2  TYR  97           HE2      TYR  97  -5.025   7.414   2.323
  780    HH   TYR  97           HH       TYR  97  -6.795   9.839   4.137
  781    H    LEU  98           H        LEU  98  -6.722   4.403  -1.788
  782    HA   LEU  98           HA       LEU  98  -4.399   5.842  -1.096
  783    HB2  LEU  98           HB3      LEU  98  -5.049   3.221  -1.910
  784    HB3  LEU  98           HB2      LEU  98  -3.846   3.801  -3.044
  785    HG   LEU  98           HG       LEU  98  -3.257   4.250  -0.179
  786   HD11  LEU  98          HD11      LEU  98  -2.261   1.805  -0.315
  787   HD12  LEU  98          HD12      LEU  98  -3.643   1.561  -1.381
  788   HD13  LEU  98          HD13      LEU  98  -3.894   2.109   0.277
  789   HD21  LEU  98          HD21      LEU  98  -1.499   4.914  -1.474
  790   HD22  LEU  98          HD22      LEU  98  -1.811   3.704  -2.717
  791   HD23  LEU  98          HD23      LEU  98  -1.042   3.233  -1.201
  792    H    LYS  99           H        LYS  99  -6.080   5.349  -4.151
  793    HA   LYS  99           HA       LYS  99  -4.144   6.367  -5.889
  794    HB2  LYS  99           HB3      LYS  99  -6.965   6.999  -6.517
  795    HB3  LYS  99           HB2      LYS  99  -5.742   6.208  -7.501
  796    HG2  LYS  99           HG3      LYS  99  -6.062   4.232  -5.844
  797    HG3  LYS  99           HG2      LYS  99  -7.593   5.032  -5.480
  798    HD2  LYS  99           HD3      LYS  99  -6.960   4.719  -8.342
  799    HD3  LYS  99           HD2      LYS  99  -7.270   3.222  -7.460
  800    HE2  LYS  99           HE3      LYS  99  -9.451   3.755  -7.047
  801    HE3  LYS  99           HE2      LYS  99  -9.140   5.489  -7.043
  802    HZ1  LYS  99           HZ1      LYS  99  -8.845   5.343  -9.480
  803    HZ2  LYS  99           HZ2      LYS  99 -10.407   4.940  -8.973
  804    HZ3  LYS  99           HZ3      LYS  99  -9.324   3.720  -9.420
  805    H    LYS 100           H        LYS 100  -6.729   8.021  -4.112
  806    HA   LYS 100           HA       LYS 100  -6.112  10.596  -5.181
  807    HB2  LYS 100           HB3      LYS 100  -7.787   9.674  -2.852
  808    HB3  LYS 100           HB2      LYS 100  -7.590  11.374  -3.254
  809    HG2  LYS 100           HG3      LYS 100  -9.192  11.233  -4.769
  810    HG3  LYS 100           HG2      LYS 100  -8.323   9.948  -5.611
  811    HD2  LYS 100           HD3      LYS 100  -9.839   8.468  -4.941
  812    HD3  LYS 100           HD2      LYS 100  -9.483   8.851  -3.256
  813    HE2  LYS 100           HE3      LYS 100 -11.298  10.581  -4.907
  814    HE3  LYS 100           HE2      LYS 100 -11.900   9.139  -4.090
  815    HZ1  LYS 100           HZ1      LYS 100 -11.787  11.567  -2.974
  816    HZ2  LYS 100           HZ2      LYS 100 -10.325  10.911  -2.432
  817    HZ3  LYS 100           HZ3      LYS 100 -11.782  10.121  -2.095
  818    H    ALA 101           H        ALA 101  -5.280   8.791  -2.320
  819    HA   ALA 101           HA       ALA 101  -4.112  10.738  -0.730
  820    HB1  ALA 101           HB1      ALA 101  -4.574   8.128  -0.405
  821    HB2  ALA 101           HB2      ALA 101  -3.450   9.033   0.609
  822    HB3  ALA 101           HB3      ALA 101  -2.842   8.069  -0.737
  823    H    THR 102           H        THR 102  -2.925   9.186  -3.583
  824    HA   THR 102           HA       THR 102  -0.278  10.392  -3.164
  825    HB   THR 102           HB       THR 102   0.593   8.690  -4.374
  826    HG1  THR 102           HG1      THR 102  -0.487   7.970  -6.348
  827   HG21  THR 102          HG21      THR 102  -1.748   7.077  -4.824
  828   HG22  THR 102          HG22      THR 102  -1.702   7.700  -3.175
  829   HG23  THR 102          HG23      THR 102  -0.343   6.769  -3.805
  830    H    ASN 103           H        ASN 103  -3.243  10.570  -4.808
  831    HA   ASN 103           HA       ASN 103  -2.527  13.114  -5.917
  832    HB2  ASN 103           HB3      ASN 103  -2.653  12.686  -8.171
  833    HB3  ASN 103           HB2      ASN 103  -1.958  11.162  -7.627
  834   HD21  ASN 103          HD21      ASN 103  -3.284   9.327  -7.496
  835   HD22  ASN 103          HD22      ASN 103  -4.770   9.227  -8.372
  836    H    GLU 104           H        GLU 104  -4.150  14.233  -5.124
  837    HA   GLU 104           HA       GLU 104  -6.605  14.575  -5.969
  838    HB2  GLU 104           HB3      GLU 104  -6.547  12.047  -4.404
  839    HB3  GLU 104           HB2      GLU 104  -7.956  13.082  -4.246
  840    HG2  GLU 104           HG3      GLU 104  -7.352  11.219  -6.286
  841    HG3  GLU 104           HG2      GLU 104  -8.779  12.238  -6.111
  842    HHA  HEC 201           HHA      HEC 201   5.093  -5.184   0.501
  843    HHB  HEC 201           HHB      HEC 201  -0.575  -2.485   0.330
  844    HHC  HEC 201           HHC      HEC 201  -2.190  -6.132   5.222
  845    HHD  HEC 201           HHD      HEC 201   4.016  -5.871   6.817
  846   HMA1  HEC 201          HMA1      HEC 201   0.848  -1.171  -1.313
  847   HMA2  HEC 201          HMA2      HEC 201   2.464  -0.257  -0.767
  848   HMA3  HEC 201          HMA3      HEC 201   2.261  -1.608  -1.623
  849   HAA1  HEC 201          HAA1      HEC 201   4.936  -3.028  -1.482
  850   HAA2  HEC 201          HAA2      HEC 201   5.524  -2.387   0.060
  851   HBA1  HEC 201          HBA1      HEC 201   4.058  -0.280  -0.319
  852   HBA2  HEC 201          HBA2      HEC 201   3.790  -0.987  -1.990
  853   HMB1  HEC 201          HMB1      HEC 201  -3.752  -1.979   2.028
  854   HMB2  HEC 201          HMB2      HEC 201  -3.833  -3.266   0.807
  855   HMB3  HEC 201          HMB3      HEC 201  -2.571  -2.010   0.695
  856    HAB  HEC 201           HAB      HEC 201  -4.053  -3.305   4.535
  857   HBB1  HEC 201          HBB1      HEC 201  -5.489  -5.282   2.752
  858   HBB2  HEC 201          HBB2      HEC 201  -4.849  -3.788   2.039
  859   HBB3  HEC 201          HBB3      HEC 201  -5.967  -3.703   3.429
  860   HMC1  HEC 201          HMC1      HEC 201  -0.969  -7.598   8.566
  861   HMC2  HEC 201          HMC2      HEC 201  -2.038  -7.728   6.971
  862   HMC3  HEC 201          HMC3      HEC 201  -0.610  -8.360   7.313
  863    HAC  HEC 201           HAC      HEC 201   2.957  -6.881   8.409
  864   HBC1  HEC 201          HBC1      HEC 201   3.230  -9.268   7.852
  865   HBC2  HEC 201          HBC2      HEC 201   1.578  -9.578   8.424
  866   HBC3  HEC 201          HBC3      HEC 201   2.831  -9.028   9.571
  867   HMD1  HEC 201          HMD1      HEC 201   5.945  -7.065   6.417
  868   HMD2  HEC 201          HMD2      HEC 201   7.086  -5.767   6.010
  869   HMD3  HEC 201          HMD3      HEC 201   7.185  -7.337   5.166
  870   HAD1  HEC 201          HAD1      HEC 201   7.885  -6.352   3.185
  871   HAD2  HEC 201          HAD2      HEC 201   7.474  -4.932   2.209
  872   HBD1  HEC 201          HBD1      HEC 201   7.793  -7.598   1.331
  873   HBD2  HEC 201          HBD2      HEC 201   7.249  -6.199   0.384
  Start of MODEL    7
    1    H1   GLY   1          1H        GLY   1 -19.414   4.071  -0.415
    2    H2   GLY   1          2H        GLY   1 -18.806   3.545  -1.903
    3    H3   GLY   1          3H        GLY   1 -18.977   5.199  -1.598
    4    HA2  GLY   1           HA2      GLY   1 -17.343   3.830   0.339
    5    HA3  GLY   1           HA3      GLY   1 -16.692   3.792  -1.292
    6    H    ASP   2           H        ASP   2 -16.580   5.357   1.555
    7    HA   ASP   2           HA       ASP   2 -16.001   7.913   0.207
    8    HB2  ASP   2           HB3      ASP   2 -16.614   7.590   3.198
    9    HB3  ASP   2           HB2      ASP   2 -16.652   9.078   2.162
   10    H    VAL   3           H        VAL   3 -14.232   9.181   1.080
   11    HA   VAL   3           HA       VAL   3 -11.874   7.683   1.399
   12    HB   VAL   3           HB       VAL   3 -12.567  10.567   1.534
   13   HG11  VAL   3          HG11      VAL   3 -11.239  10.639   3.434
   14   HG12  VAL   3          HG12      VAL   3 -10.083  10.958   2.140
   15   HG13  VAL   3          HG13      VAL   3 -10.177   9.352   2.863
   16   HG21  VAL   3          HG21      VAL   3 -11.813  10.291  -0.549
   17   HG22  VAL   3          HG22      VAL   3 -11.088   8.728  -0.166
   18   HG23  VAL   3          HG23      VAL   3 -10.201  10.217   0.162
   19    H    GLU   4           H        GLU   4 -13.911   9.395   3.734
   20    HA   GLU   4           HA       GLU   4 -12.277   9.101   6.033
   21    HB2  GLU   4           HB3      GLU   4 -14.198  10.566   6.067
   22    HB3  GLU   4           HB2      GLU   4 -15.289   9.211   5.818
   23    HG2  GLU   4           HG3      GLU   4 -14.397   8.306   8.026
   24    HG3  GLU   4           HG2      GLU   4 -13.709   9.910   8.266
   25    H    LYS   5           H        LYS   5 -14.816   6.957   4.784
   26    HA   LYS   5           HA       LYS   5 -14.639   5.036   6.843
   27    HB2  LYS   5           HB3      LYS   5 -15.507   4.604   3.978
   28    HB3  LYS   5           HB2      LYS   5 -15.888   3.616   5.370
   29    HG2  LYS   5           HG3      LYS   5 -16.806   6.034   6.164
   30    HG3  LYS   5           HG2      LYS   5 -17.155   6.036   4.432
   31    HD2  LYS   5           HD3      LYS   5 -17.824   3.534   5.813
   32    HD3  LYS   5           HD2      LYS   5 -18.756   4.937   6.342
   33    HE2  LYS   5           HE3      LYS   5 -20.026   4.774   4.531
   34    HE3  LYS   5           HE2      LYS   5 -18.607   5.016   3.515
   35    HZ1  LYS   5           HZ1      LYS   5 -20.130   2.679   3.870
   36    HZ2  LYS   5           HZ2      LYS   5 -18.553   2.380   4.401
   37    HZ3  LYS   5           HZ3      LYS   5 -18.822   2.939   2.827
   38    H    GLY   6           H        GLY   6 -12.967   5.405   3.763
   39    HA2  GLY   6           HA3      GLY   6 -11.697   2.891   3.701
   40    HA3  GLY   6           HA2      GLY   6 -11.133   4.342   2.886
   41    H    LYS   7           H        LYS   7 -10.661   5.755   4.812
   42    HA   LYS   7           HA       LYS   7  -8.011   5.141   5.465
   43    HB2  LYS   7           HB3      LYS   7  -8.041   7.361   5.692
   44    HB3  LYS   7           HB2      LYS   7  -9.797   7.373   5.771
   45    HG2  LYS   7           HG3      LYS   7  -9.834   7.438   8.045
   46    HG3  LYS   7           HG2      LYS   7  -8.313   6.560   8.206
   47    HD2  LYS   7           HD3      LYS   7  -8.697   9.452   7.454
   48    HD3  LYS   7           HD2      LYS   7  -7.930   8.810   8.908
   49    HE2  LYS   7           HE3      LYS   7  -6.256   7.707   7.341
   50    HE3  LYS   7           HE2      LYS   7  -6.920   8.742   6.079
   51    HZ1  LYS   7           HZ1      LYS   7  -5.934   9.862   8.629
   52    HZ2  LYS   7           HZ2      LYS   7  -6.174  10.653   7.154
   53    HZ3  LYS   7           HZ3      LYS   7  -4.887   9.569   7.333
   54    H    LYS   8           H        LYS   8 -10.853   4.977   7.597
   55    HA   LYS   8           HA       LYS   8  -9.900   3.859  10.009
   56    HB2  LYS   8           HB3      LYS   8 -12.037   4.602  10.302
   57    HB3  LYS   8           HB2      LYS   8 -12.532   4.147   8.678
   58    HG2  LYS   8           HG3      LYS   8 -11.926   1.942  10.547
   59    HG3  LYS   8           HG2      LYS   8 -13.382   2.885  10.865
   60    HD2  LYS   8           HD3      LYS   8 -14.292   2.366   8.740
   61    HD3  LYS   8           HD2      LYS   8 -12.754   1.720   8.163
   62    HE2  LYS   8           HE3      LYS   8 -14.000   0.469  10.555
   63    HE3  LYS   8           HE2      LYS   8 -14.715   0.140   8.976
   64    HZ1  LYS   8           HZ1      LYS   8 -11.834  -0.232   9.565
   65    HZ2  LYS   8           HZ2      LYS   8 -12.684  -0.767   8.205
   66    HZ3  LYS   8           HZ3      LYS   8 -12.977  -1.469   9.714
   67    H    ILE   9           H        ILE   9 -11.001   2.423   6.978
   68    HA   ILE   9           HA       ILE   9 -11.031  -0.258   7.807
   69    HB   ILE   9           HB       ILE   9 -10.825   1.102   5.161
   70   HG12  ILE   9          HG13      ILE   9 -12.670  -1.039   6.249
   71   HG13  ILE   9          HG12      ILE   9 -13.007   0.690   6.268
   72   HG21  ILE   9          HG21      ILE   9 -10.575  -1.937   5.388
   73   HG22  ILE   9          HG22      ILE   9  -9.184  -0.812   5.180
   74   HG23  ILE   9          HG23      ILE   9 -10.449  -0.900   3.955
   75   HD11  ILE   9          HD11      ILE   9 -13.181  -1.303   4.044
   76   HD12  ILE   9          HD12      ILE   9 -12.510   0.330   3.649
   77   HD13  ILE   9          HD13      ILE   9 -14.112   0.210   4.377
   78    H    PHE  10           H        PHE  10  -8.473   1.703   6.336
   79    HA   PHE  10           HA       PHE  10  -6.529  -0.344   6.188
   80    HB2  PHE  10           HB3      PHE  10  -5.938   1.430   4.856
   81    HB3  PHE  10           HB2      PHE  10  -6.514   2.626   6.005
   82    HD1  PHE  10           HD1      PHE  10  -3.678   1.371   4.514
   83    HD2  PHE  10           HD2      PHE  10  -5.116   2.565   8.325
   84    HE1  PHE  10           HE1      PHE  10  -1.372   1.761   5.275
   85    HE2  PHE  10           HE2      PHE  10  -2.841   2.964   9.094
   86    HZ   PHE  10           HZ       PHE  10  -0.950   2.559   7.567
   87    H    VAL  11           H        VAL  11  -7.391   1.994   8.706
   88    HA   VAL  11           HA       VAL  11  -5.223   1.820  10.389
   89    HB   VAL  11           HB       VAL  11  -8.140   2.077  11.094
   90   HG11  VAL  11          HG11      VAL  11  -5.691   2.261  12.825
   91   HG12  VAL  11          HG12      VAL  11  -7.150   1.304  13.082
   92   HG13  VAL  11          HG13      VAL  11  -7.206   3.059  13.250
   93   HG21  VAL  11          HG21      VAL  11  -6.256   3.849   9.940
   94   HG22  VAL  11          HG22      VAL  11  -6.590   4.415  11.577
   95   HG23  VAL  11          HG23      VAL  11  -7.915   4.184  10.434
   96    H    GLN  12           H        GLN  12  -8.094  -0.336  10.432
   97    HA   GLN  12           HA       GLN  12  -6.791  -2.065  12.451
   98    HB2  GLN  12           HB3      GLN  12  -9.131  -3.251  11.193
   99    HB3  GLN  12           HB2      GLN  12  -8.874  -2.822  12.879
  100    HG2  GLN  12           HG3      GLN  12  -9.259  -0.378  11.745
  101    HG3  GLN  12           HG2      GLN  12 -10.315  -1.401  10.769
  102   HE21  GLN  12          HE21      GLN  12 -12.070  -0.212  11.684
  103   HE22  GLN  12          HE22      GLN  12 -12.663  -0.606  13.258
  104    H    LYS  13           H        LYS  13  -7.870  -2.120   9.273
  105    HA   LYS  13           HA       LYS  13  -7.373  -4.161   7.715
  106    HB2  LYS  13           HB3      LYS  13  -6.946  -1.337   7.538
  107    HB3  LYS  13           HB2      LYS  13  -5.450  -2.059   6.973
  108    HG2  LYS  13           HG3      LYS  13  -8.116  -2.049   5.760
  109    HG3  LYS  13           HG2      LYS  13  -6.523  -2.150   5.009
  110    HD2  LYS  13           HD3      LYS  13  -6.447  -4.629   5.815
  111    HD3  LYS  13           HD2      LYS  13  -8.161  -4.458   6.195
  112    HE2  LYS  13           HE3      LYS  13  -6.896  -5.005   3.674
  113    HE3  LYS  13           HE2      LYS  13  -8.606  -5.052   4.100
  114    HZ1  LYS  13           HZ1      LYS  13  -8.785  -2.716   3.651
  115    HZ2  LYS  13           HZ2      LYS  13  -8.098  -3.472   2.304
  116    HZ3  LYS  13           HZ3      LYS  13  -7.124  -2.586   3.364
  117    H    CYS  14           H        CYS  14  -4.600  -2.458   9.179
  118    HA   CYS  14           HA       CYS  14  -2.874  -4.437   9.578
  119    HB2  CYS  14           HB3      CYS  14  -1.542  -4.908   7.723
  120    HB3  CYS  14           HB2      CYS  14  -3.196  -5.573   7.512
  121    H    ALA  15           H        ALA  15  -3.490  -1.410   9.831
  122    HA   ALA  15           HA       ALA  15  -1.374  -0.078   8.650
  123    HB1  ALA  15           HB1      ALA  15  -2.608   0.764  11.259
  124    HB2  ALA  15           HB2      ALA  15  -3.440   0.916   9.712
  125    HB3  ALA  15           HB3      ALA  15  -1.931   1.787   9.993
  126    H    GLN  16           H        GLN  16  -1.466  -1.877  11.639
  127    HA   GLN  16           HA       GLN  16   0.864  -0.904  12.954
  128    HB2  GLN  16           HB3      GLN  16   0.571  -3.843  13.000
  129    HB3  GLN  16           HB2      GLN  16   0.652  -2.651  14.353
  130    HG2  GLN  16           HG3      GLN  16  -1.819  -2.008  13.667
  131    HG3  GLN  16           HG2      GLN  16  -1.824  -3.465  12.673
  132   HE21  GLN  16          HE21      GLN  16  -0.548  -2.693  15.930
  133   HE22  GLN  16          HE22      GLN  16  -1.467  -3.970  16.725
  134    H    CYS  17           H        CYS  17   0.593  -3.149  10.183
  135    HA   CYS  17           HA       CYS  17   3.389  -3.803  10.187
  136    HB2  CYS  17           HB3      CYS  17   1.543  -4.148   7.837
  137    HB3  CYS  17           HB2      CYS  17   2.938  -5.122   8.290
  138    H    HIS  18           H        HIS  18   1.459  -1.249   8.960
  139    HA   HIS  18           HA       HIS  18   3.665  -0.353   7.232
  140    HB2  HIS  18           HB3      HIS  18   0.763   0.487   7.147
  141    HB3  HIS  18           HB2      HIS  18   2.023   0.990   6.025
  142    HD1  HIS  18           HD1      HIS  18   1.737  -0.183   3.877
  143    HD2  HIS  18           HD2      HIS  18   0.796  -2.630   7.099
  144    HE1  HIS  18           HE1      HIS  18   1.130  -2.408   2.876
  145    H    THR  19           H        THR  19   3.225  -0.011  10.282
  146    HA   THR  19           HA       THR  19   3.400   1.586  11.892
  147    HB   THR  19           HB       THR  19   4.853   3.084   9.705
  148    HG1  THR  19           HG1      THR  19   6.677   2.004  10.465
  149   HG21  THR  19          HG21      THR  19   5.309   3.202  12.671
  150   HG22  THR  19          HG22      THR  19   4.389   4.400  11.761
  151   HG23  THR  19          HG23      THR  19   6.102   4.159  11.420
  152    H    VAL  20           H        VAL  20   2.776   3.728  12.601
  153    HA   VAL  20           HA       VAL  20   0.265   4.619  11.261
  154    HB   VAL  20           HB       VAL  20   1.481   5.928  13.707
  155   HG11  VAL  20          HG11      VAL  20  -0.761   6.607  12.380
  156   HG12  VAL  20          HG12      VAL  20  -0.803   6.555  14.142
  157   HG13  VAL  20          HG13      VAL  20  -1.472   5.220  13.204
  158   HG21  VAL  20          HG21      VAL  20   0.376   4.255  15.115
  159   HG22  VAL  20          HG22      VAL  20   1.676   3.495  14.060
  160   HG23  VAL  20          HG23      VAL  20  -0.140   3.343  13.697
  161    H    GLU  21           H        GLU  21   0.817   7.348  12.589
  162    HA   GLU  21           HA       GLU  21   1.523   8.709  10.219
  163    HB2  GLU  21           HB3      GLU  21   1.898  10.307  12.609
  164    HB3  GLU  21           HB2      GLU  21   0.729  10.495  11.310
  165    HG2  GLU  21           HG3      GLU  21  -0.715   8.843  12.379
  166    HG3  GLU  21           HG2      GLU  21   0.454   8.661  13.682
  167    H    LYS  22           H        LYS  22   3.464   9.816   9.651
  168    HA   LYS  22           HA       LYS  22   5.919   8.672  10.173
  169    HB2  LYS  22           HB3      LYS  22   5.226  10.326   8.319
  170    HB3  LYS  22           HB2      LYS  22   5.651  11.585   9.470
  171    HG2  LYS  22           HG3      LYS  22   7.459   9.486   8.302
  172    HG3  LYS  22           HG2      LYS  22   7.520  11.231   8.046
  173    HD2  LYS  22           HD3      LYS  22   8.044   9.780  10.639
  174    HD3  LYS  22           HD2      LYS  22   9.252  10.547   9.606
  175    HE2  LYS  22           HE3      LYS  22   8.318  12.717  10.031
  176    HE3  LYS  22           HE2      LYS  22   6.959  12.010  10.903
  177    HZ1  LYS  22           HZ1      LYS  22   9.455  12.779  11.912
  178    HZ2  LYS  22           HZ2      LYS  22   9.323  11.100  12.088
  179    HZ3  LYS  22           HZ3      LYS  22   8.145  12.114  12.752
  180    H    GLY  23           H        GLY  23   7.155   8.630  11.901
  181    HA2  GLY  23           HA3      GLY  23   8.311  10.488  13.374
  182    HA3  GLY  23           HA2      GLY  23   6.689  10.550  14.055
  183    H    GLY  24           H        GLY  24   6.228   7.687  13.693
  184    HA2  GLY  24           HA3      GLY  24   7.415   6.808  16.167
  185    HA3  GLY  24           HA2      GLY  24   6.305   5.893  15.156
  186    H    LYS  25           H        LYS  25   7.236   4.008  14.691
  187    HA   LYS  25           HA       LYS  25  10.089   4.003  13.958
  188    HB2  LYS  25           HB3      LYS  25   8.926   1.380  14.431
  189    HB3  LYS  25           HB2      LYS  25  10.353   2.120  15.144
  190    HG2  LYS  25           HG3      LYS  25   9.229   2.872  16.967
  191    HG3  LYS  25           HG2      LYS  25   7.714   3.075  16.087
  192    HD2  LYS  25           HD3      LYS  25   8.929   0.463  16.984
  193    HD3  LYS  25           HD2      LYS  25   7.520   1.259  17.689
  194    HE2  LYS  25           HE3      LYS  25   6.192   0.278  16.206
  195    HE3  LYS  25           HE2      LYS  25   7.114   0.986  14.879
  196    HZ1  LYS  25           HZ1      LYS  25   7.152  -1.700  15.906
  197    HZ2  LYS  25           HZ2      LYS  25   8.697  -1.047  15.690
  198    HZ3  LYS  25           HZ3      LYS  25   7.620  -1.116  14.390
  199    H    HIS  26           H        HIS  26  10.758   2.592  12.219
  200    HA   HIS  26           HA       HIS  26   9.158   2.851   9.918
  201    HB2  HIS  26           HB3      HIS  26  11.060   0.755   9.531
  202    HB3  HIS  26           HB2      HIS  26  11.109   2.407   8.925
  203    HD1  HIS  26           HD1      HIS  26  11.843   0.740  12.279
  204    HD2  HIS  26           HD2      HIS  26  13.372   3.629   9.714
  205    HE1  HIS  26           HE1      HIS  26  13.946   1.570  13.381
  206    HE2  HIS  26           HE2      HIS  26  14.802   3.384  11.856
  207    H    LYS  27           H        LYS  27   7.883   1.436   8.808
  208    HA   LYS  27           HA       LYS  27   6.819  -0.786  10.340
  209    HB2  LYS  27           HB3      LYS  27   4.960  -0.672   8.986
  210    HB3  LYS  27           HB2      LYS  27   5.525   0.990   8.899
  211    HG2  LYS  27           HG3      LYS  27   6.866  -0.285   6.838
  212    HG3  LYS  27           HG2      LYS  27   5.243  -0.981   6.806
  213    HD2  LYS  27           HD3      LYS  27   5.690   1.160   5.443
  214    HD3  LYS  27           HD2      LYS  27   4.233   1.085   6.437
  215    HE2  LYS  27           HE3      LYS  27   4.898   2.806   7.687
  216    HE3  LYS  27           HE2      LYS  27   6.495   2.099   7.930
  217    HZ1  LYS  27           HZ1      LYS  27   7.276   3.071   5.942
  218    HZ2  LYS  27           HZ2      LYS  27   6.445   4.297   6.759
  219    HZ3  LYS  27           HZ3      LYS  27   5.720   3.517   5.444
  220    H    THR  28           H        THR  28   6.206  -2.791   8.963
  221    HA   THR  28           HA       THR  28   8.628  -4.019   8.143
  222    HB   THR  28           HB       THR  28   6.006  -5.216   7.389
  223    HG1  THR  28           HG1      THR  28   6.833  -5.242  10.079
  224   HG21  THR  28          HG21      THR  28   6.933  -7.326   7.929
  225   HG22  THR  28          HG22      THR  28   8.139  -6.493   9.041
  226   HG23  THR  28          HG23      THR  28   8.300  -6.442   7.248
  227    H    GLY  29           H        GLY  29   5.860  -2.685   6.407
  228    HA2  GLY  29           HA3      GLY  29   7.463  -2.821   3.937
  229    HA3  GLY  29           HA2      GLY  29   5.794  -3.374   3.930
  230    HA   PRO  30           HA       PRO  30   6.659   1.431   3.166
  231    HB2  PRO  30           HB3      PRO  30   5.592   0.477   0.465
  232    HB3  PRO  30           HB2      PRO  30   6.713   1.807   0.783
  233    HG2  PRO  30           HG3      PRO  30   7.607  -0.547  -0.094
  234    HG3  PRO  30           HG2      PRO  30   8.516   0.388   1.106
  235    HD2  PRO  30           HD3      PRO  30   6.916  -2.130   1.531
  236    HD3  PRO  30           HD2      PRO  30   8.312  -1.549   2.464
  237    H    ASN  31           H        ASN  31   5.013   2.470   4.081
  238    HA   ASN  31           HA       ASN  31   2.458   1.485   4.482
  239    HB2  ASN  31           HB3      ASN  31   3.757   3.597   5.449
  240    HB3  ASN  31           HB2      ASN  31   2.797   4.436   4.234
  241   HD21  ASN  31          HD21      ASN  31   2.131   5.368   6.435
  242   HD22  ASN  31          HD22      ASN  31   0.628   4.667   7.149
  243    H    LEU  32           H        LEU  32   3.352   4.116   2.096
  244    HA   LEU  32           HA       LEU  32   1.874   3.059   0.049
  245    HB2  LEU  32           HB3      LEU  32  -0.023   4.568  -0.214
  246    HB3  LEU  32           HB2      LEU  32  -0.059   3.608   1.255
  247    HG   LEU  32           HG       LEU  32  -1.109   5.737   1.818
  248   HD11  LEU  32          HD11      LEU  32   1.555   5.365   2.759
  249   HD12  LEU  32          HD12      LEU  32   0.128   4.684   3.538
  250   HD13  LEU  32          HD13      LEU  32   0.395   6.426   3.559
  251   HD21  LEU  32          HD21      LEU  32  -0.336   7.699   1.056
  252   HD22  LEU  32          HD22      LEU  32   0.334   6.623  -0.170
  253   HD23  LEU  32          HD23      LEU  32   1.325   7.141   1.200
  254    H    HIS  33           H        HIS  33   3.363   5.766   1.552
  255    HA   HIS  33           HA       HIS  33   3.437   7.698  -0.395
  256    HB2  HIS  33           HB3      HIS  33   4.757   7.233   2.022
  257    HB3  HIS  33           HB2      HIS  33   6.048   7.413   0.840
  258    HD1  HIS  33           HD1      HIS  33   6.695   9.677   1.985
  259    HD2  HIS  33           HD2      HIS  33   2.906   9.603   0.279
  260    HE1  HIS  33           HE1      HIS  33   5.964  12.080   1.867
  261    HE2  HIS  33           HE2      HIS  33   3.635  12.003   0.912
  262    H    GLY  34           H        GLY  34   4.173   7.785  -2.410
  263    HA2  GLY  34           HA3      GLY  34   5.474   7.393  -4.269
  264    HA3  GLY  34           HA2      GLY  34   6.644   6.607  -3.217
  265    H    LEU  35           H        LEU  35   3.456   5.402  -3.001
  266    HA   LEU  35           HA       LEU  35   4.174   2.805  -3.771
  267    HB2  LEU  35           HB3      LEU  35   2.250   3.403  -2.312
  268    HB3  LEU  35           HB2      LEU  35   1.405   4.007  -3.724
  269    HG   LEU  35           HG       LEU  35   1.333   1.781  -4.689
  270   HD11  LEU  35          HD11      LEU  35   2.480  -0.099  -3.999
  271   HD12  LEU  35          HD12      LEU  35   2.372   0.464  -2.262
  272   HD13  LEU  35          HD13      LEU  35   3.564   1.234  -3.308
  273   HD21  LEU  35          HD21      LEU  35   0.255   2.155  -1.886
  274   HD22  LEU  35          HD22      LEU  35  -0.035   0.649  -2.754
  275   HD23  LEU  35          HD23      LEU  35  -0.653   2.169  -3.397
  276    H    PHE  36           H        PHE  36   2.365   5.309  -5.527
  277    HA   PHE  36           HA       PHE  36   2.718   3.739  -7.990
  278    HB2  PHE  36           HB3      PHE  36   0.745   6.067  -7.918
  279    HB3  PHE  36           HB2      PHE  36   0.611   4.538  -8.779
  280    HD1  PHE  36           HD1      PHE  36  -0.446   2.547  -7.817
  281    HD2  PHE  36           HD2      PHE  36   0.118   6.226  -5.557
  282    HE1  PHE  36           HE1      PHE  36  -1.980   1.708  -6.087
  283    HE2  PHE  36           HE2      PHE  36  -1.416   5.394  -3.823
  284    HZ   PHE  36           HZ       PHE  36  -2.459   3.167  -4.069
  285    H    GLY  37           H        GLY  37   4.459   5.835  -6.505
  286    HA2  GLY  37           HA3      GLY  37   4.977   7.485  -8.902
  287    HA3  GLY  37           HA2      GLY  37   5.106   8.131  -7.272
  288    H    ARG  38           H        ARG  38   6.380   5.890  -6.080
  289    HA   ARG  38           HA       ARG  38   9.076   6.335  -7.075
  290    HB2  ARG  38           HB3      ARG  38   8.018   4.964  -4.601
  291    HB3  ARG  38           HB2      ARG  38   9.727   5.064  -5.004
  292    HG2  ARG  38           HG3      ARG  38   9.399   7.587  -5.069
  293    HG3  ARG  38           HG2      ARG  38   7.850   7.286  -4.278
  294    HD2  ARG  38           HD3      ARG  38   8.844   7.041  -2.306
  295    HD3  ARG  38           HD2      ARG  38   9.930   5.816  -2.957
  296    HE   ARG  38           HE       ARG  38  11.539   7.404  -2.706
  297   HH11  ARG  38          HH11      ARG  38   8.606   8.970  -3.742
  298   HH12  ARG  38          HH12      ARG  38   9.333  10.537  -3.866
  299   HH21  ARG  38          HH21      ARG  38  12.507   9.464  -2.864
  300   HH22  ARG  38          HH22      ARG  38  11.551  10.818  -3.366
  301    H    LYS  39           H        LYS  39  10.587   4.385  -7.056
  302    HA   LYS  39           HA       LYS  39   9.823   2.599  -9.026
  303    HB2  LYS  39           HB3      LYS  39  12.170   3.063  -8.437
  304    HB3  LYS  39           HB2      LYS  39  11.962   2.176  -6.934
  305    HG2  LYS  39           HG3      LYS  39  12.926   1.127  -9.254
  306    HG3  LYS  39           HG2      LYS  39  12.213   0.100  -7.975
  307    HD2  LYS  39           HD3      LYS  39  11.234  -0.540 -10.116
  308    HD3  LYS  39           HD2      LYS  39  10.023   0.197  -9.065
  309    HE2  LYS  39           HE3      LYS  39  10.616   2.468 -10.233
  310    HE3  LYS  39           HE2      LYS  39  11.372   1.351 -11.479
  311    HZ1  LYS  39           HZ1      LYS  39   9.396   0.562 -12.214
  312    HZ2  LYS  39           HZ2      LYS  39   8.842   2.053 -11.638
  313    HZ3  LYS  39           HZ3      LYS  39   8.648   0.665 -10.690
  314    H    THR  40           H        THR  40  10.954   0.986  -6.161
  315    HA   THR  40           HA       THR  40   8.369   0.052  -5.351
  316    HB   THR  40           HB       THR  40   8.874  -2.216  -5.124
  317    HG1  THR  40           HG1      THR  40  10.354  -3.411  -6.028
  318   HG21  THR  40          HG21      THR  40   8.552  -1.974  -7.875
  319   HG22  THR  40          HG22      THR  40   8.838  -2.811  -6.664
  320   HG23  THR  40          HG23      THR  40   7.447  -2.837  -6.361
  321    H    GLY  41           H        GLY  41   8.312   0.502  -3.558
  322    HA2  GLY  41           HA3      GLY  41   8.817   0.547  -1.319
  323    HA3  GLY  41           HA2      GLY  41   9.476  -1.059  -1.585
  324    H    GLN  42           H        GLN  42  10.684   1.952  -2.984
  325    HA   GLN  42           HA       GLN  42  13.249   1.431  -1.661
  326    HB2  GLN  42           HB3      GLN  42  13.732   3.462  -3.439
  327    HB3  GLN  42           HB2      GLN  42  13.980   1.751  -3.759
  328    HG2  GLN  42           HG3      GLN  42  12.733   2.914  -5.537
  329    HG3  GLN  42           HG2      GLN  42  11.838   1.577  -4.818
  330   HE21  GLN  42          HE21      GLN  42   9.774   2.084  -4.820
  331   HE22  GLN  42          HE22      GLN  42   9.094   3.592  -4.322
  332    H    ALA  43           H        ALA  43  11.329   2.488  -0.002
  333    HA   ALA  43           HA       ALA  43  11.126   5.244   0.188
  334    HB1  ALA  43           HB1      ALA  43  11.249   4.417   2.819
  335    HB2  ALA  43           HB2      ALA  43  10.714   2.976   1.954
  336    HB3  ALA  43           HB3      ALA  43   9.804   4.481   1.812
  337    HA   PRO  44           HA       PRO  44  14.980   6.741   1.727
  338    HB2  PRO  44           HB3      PRO  44  14.364   8.421   3.721
  339    HB3  PRO  44           HB2      PRO  44  13.851   8.735   2.060
  340    HG2  PRO  44           HG3      PRO  44  12.285   7.596   4.342
  341    HG3  PRO  44           HG2      PRO  44  11.791   8.796   3.135
  342    HD2  PRO  44           HD3      PRO  44  11.147   6.129   3.005
  343    HD3  PRO  44           HD2      PRO  44  11.315   7.251   1.567
  344    H    GLY  45           H        GLY  45  14.058   7.282   4.960
  345    HA2  GLY  45           HA3      GLY  45  16.087   5.546   6.008
  346    HA3  GLY  45           HA2      GLY  45  14.955   6.488   6.966
  347    H    PHE  46           H        PHE  46  13.231   4.633   4.766
  348    HA   PHE  46           HA       PHE  46  12.329   2.853   6.849
  349    HB2  PHE  46           HB3      PHE  46  10.708   3.856   5.310
  350    HB3  PHE  46           HB2      PHE  46  11.500   3.070   3.948
  351    HD1  PHE  46           HD1      PHE  46   9.712   2.369   7.121
  352    HD2  PHE  46           HD2      PHE  46  10.862   0.936   3.284
  353    HE1  PHE  46           HE1      PHE  46   8.267   0.401   7.428
  354    HE2  PHE  46           HE2      PHE  46   9.419  -1.034   3.583
  355    HZ   PHE  46           HZ       PHE  46   8.120  -1.305   5.656
  356    H    THR  47           H        THR  47  12.799   0.733   7.111
  357    HA   THR  47           HA       THR  47  14.979  -0.354   5.575
  358    HB   THR  47           HB       THR  47  14.054  -0.717   8.155
  359    HG1  THR  47           HG1      THR  47  15.753  -2.235   8.253
  360   HG21  THR  47          HG21      THR  47  13.726  -3.188   8.294
  361   HG22  THR  47          HG22      THR  47  13.442  -3.183   6.554
  362   HG23  THR  47          HG23      THR  47  12.363  -2.289   7.627
  363    H    TYR  48           H        TYR  48  14.438  -0.898   3.550
  364    HA   TYR  48           HA       TYR  48  11.929  -2.050   2.834
  365    HB2  TYR  48           HB3      TYR  48  13.858  -2.527   0.750
  366    HB3  TYR  48           HB2      TYR  48  12.587  -1.310   0.766
  367    HD1  TYR  48           HD1      TYR  48  16.025  -1.905   2.153
  368    HD2  TYR  48           HD2      TYR  48  13.195   0.919   0.607
  369    HE1  TYR  48           HE1      TYR  48  17.742  -0.117   2.175
  370    HE2  TYR  48           HE2      TYR  48  14.899   2.690   0.678
  371    HH   TYR  48           HH       TYR  48  18.012   2.188   2.167
  372    H    THR  49           H        THR  49  11.643  -4.162   1.754
  373    HA   THR  49           HA       THR  49  12.923  -6.298   3.210
  374    HB   THR  49           HB       THR  49  11.318  -7.746   2.145
  375    HG1  THR  49           HG1      THR  49   9.869  -6.701   0.549
  376   HG21  THR  49          HG21      THR  49   9.410  -5.586   2.294
  377   HG22  THR  49          HG22      THR  49  10.521  -5.581   3.664
  378   HG23  THR  49          HG23      THR  49   9.575  -7.024   3.301
  379    H    ASP  50           H        ASP  50  13.588  -8.301   1.837
  380    HA   ASP  50           HA       ASP  50  15.850  -7.649   0.375
  381    HB2  ASP  50           HB3      ASP  50  15.891  -9.850   1.066
  382    HB3  ASP  50           HB2      ASP  50  14.197 -10.117   0.665
  383    H    ALA  51           H        ALA  51  12.538  -8.145  -0.686
  384    HA   ALA  51           HA       ALA  51  13.103  -8.095  -3.532
  385    HB1  ALA  51           HB1      ALA  51  10.980  -8.733  -3.632
  386    HB2  ALA  51           HB2      ALA  51  10.455  -7.172  -3.003
  387    HB3  ALA  51           HB3      ALA  51  10.839  -8.487  -1.891
  388    H    ASN  52           H        ASN  52  12.009  -5.613  -1.232
  389    HA   ASN  52           HA       ASN  52  11.686  -3.530  -3.082
  390    HB2  ASN  52           HB3      ASN  52  12.420  -3.416  -0.150
  391    HB3  ASN  52           HB2      ASN  52  11.934  -1.971  -1.084
  392   HD21  ASN  52          HD21      ASN  52  10.133  -4.124  -2.540
  393   HD22  ASN  52          HD22      ASN  52   8.734  -4.174  -1.528
  394    H    LYS  53           H        LYS  53  14.492  -4.506  -1.152
  395    HA   LYS  53           HA       LYS  53  16.227  -2.383  -1.878
  396    HB2  LYS  53           HB3      LYS  53  18.042  -4.121  -1.371
  397    HB3  LYS  53           HB2      LYS  53  16.892  -3.753  -0.061
  398    HG2  LYS  53           HG3      LYS  53  15.752  -5.862  -0.499
  399    HG3  LYS  53           HG2      LYS  53  16.691  -6.144  -1.967
  400    HD2  LYS  53           HD3      LYS  53  17.845  -7.473  -0.507
  401    HD3  LYS  53           HD2      LYS  53  18.720  -5.958  -0.286
  402    HE2  LYS  53           HE3      LYS  53  18.213  -6.026   1.929
  403    HE3  LYS  53           HE2      LYS  53  16.499  -5.937   1.523
  404    HZ1  LYS  53           HZ1      LYS  53  18.019  -8.150   2.499
  405    HZ2  LYS  53           HZ2      LYS  53  17.164  -8.551   1.095
  406    HZ3  LYS  53           HZ3      LYS  53  16.341  -7.938   2.441
  407    H    ASN  54           H        ASN  54  15.242  -5.364  -3.519
  408    HA   ASN  54           HA       ASN  54  17.271  -5.261  -5.545
  409    HB2  ASN  54           HB3      ASN  54  14.642  -6.762  -5.494
  410    HB3  ASN  54           HB2      ASN  54  15.948  -7.024  -6.645
  411   HD21  ASN  54          HD21      ASN  54  17.316  -6.243  -3.760
  412   HD22  ASN  54          HD22      ASN  54  17.599  -7.829  -3.136
  413    H    LYS  55           H        LYS  55  14.343  -3.647  -4.961
  414    HA   LYS  55           HA       LYS  55  13.301  -1.969  -6.101
  415    HB2  LYS  55           HB3      LYS  55  15.588  -2.442  -8.000
  416    HB3  LYS  55           HB2      LYS  55  14.313  -1.285  -8.355
  417    HG2  LYS  55           HG3      LYS  55  15.141   0.285  -6.911
  418    HG3  LYS  55           HG2      LYS  55  15.485  -0.920  -5.669
  419    HD2  LYS  55           HD3      LYS  55  17.175  -0.123  -8.025
  420    HD3  LYS  55           HD2      LYS  55  17.584  -0.056  -6.309
  421    HE2  LYS  55           HE3      LYS  55  17.191  -2.694  -6.453
  422    HE3  LYS  55           HE2      LYS  55  17.477  -2.456  -8.177
  423    HZ1  LYS  55           HZ1      LYS  55  19.563  -2.922  -7.290
  424    HZ2  LYS  55           HZ2      LYS  55  19.321  -1.956  -5.923
  425    HZ3  LYS  55           HZ3      LYS  55  19.565  -1.236  -7.434
  426    H    GLY  56           H        GLY  56  11.867  -4.039  -6.148
  427    HA2  GLY  56           HA3      GLY  56  11.435  -5.550  -8.429
  428    HA3  GLY  56           HA2      GLY  56  10.188  -5.129  -7.266
  429    H    ILE  57           H        ILE  57   8.601  -3.767  -7.878
  430    HA   ILE  57           HA       ILE  57   9.070  -1.966 -10.097
  431    HB   ILE  57           HB       ILE  57   7.930  -4.385 -10.669
  432   HG12  ILE  57          HG13      ILE  57   8.790  -3.267 -12.444
  433   HG13  ILE  57          HG12      ILE  57   7.085  -2.928 -12.725
  434   HG21  ILE  57          HG21      ILE  57   5.852  -4.031  -9.649
  435   HG22  ILE  57          HG22      ILE  57   5.587  -3.675 -11.355
  436   HG23  ILE  57          HG23      ILE  57   5.778  -2.358 -10.199
  437   HD11  ILE  57          HD11      ILE  57   7.306  -0.745 -12.200
  438   HD12  ILE  57          HD12      ILE  57   8.964  -1.048 -12.721
  439   HD13  ILE  57          HD13      ILE  57   8.564  -1.047 -11.001
  440    H    THR  58           H        THR  58   7.074  -0.596 -10.540
  441    HA   THR  58           HA       THR  58   6.208   0.489  -8.027
  442    HB   THR  58           HB       THR  58   6.633   1.486 -10.616
  443    HG1  THR  58           HG1      THR  58   6.116   3.568  -9.528
  444   HG21  THR  58          HG21      THR  58   4.274   0.946 -11.133
  445   HG22  THR  58          HG22      THR  58   4.636   2.671 -11.184
  446   HG23  THR  58          HG23      THR  58   3.783   1.990  -9.798
  447    H    TRP  59           H        TRP  59   4.560  -0.280  -6.988
  448    HA   TRP  59           HA       TRP  59   2.598  -2.001  -8.092
  449    HB2  TRP  59           HB3      TRP  59   1.935  -0.578  -5.585
  450    HB3  TRP  59           HB2      TRP  59   1.927  -2.303  -5.940
  451    HD1  TRP  59           HD1      TRP  59   4.389   0.604  -4.923
  452    HE1  TRP  59           HE1      TRP  59   6.432  -0.552  -3.851
  453    HE3  TRP  59           HE3      TRP  59   3.218  -4.414  -5.675
  454    HZ2  TRP  59           HZ2      TRP  59   7.431  -3.148  -3.341
  455    HZ3  TRP  59           HZ3      TRP  59   4.782  -6.124  -4.840
  456    HH2  TRP  59           HH2      TRP  59   6.845  -5.497  -3.695
  457    H    LYS  60           H        LYS  60   1.174  -1.344  -9.547
  458    HA   LYS  60           HA       LYS  60  -0.148   1.353  -9.260
  459    HB2  LYS  60           HB3      LYS  60   0.164   1.448 -11.481
  460    HB3  LYS  60           HB2      LYS  60   0.868  -0.221 -11.509
  461    HG2  LYS  60           HG3      LYS  60  -0.968  -0.539 -12.885
  462    HG3  LYS  60           HG2      LYS  60  -1.883  -0.670 -11.382
  463    HD2  LYS  60           HD3      LYS  60  -3.000   1.234 -11.768
  464    HD3  LYS  60           HD2      LYS  60  -1.549   2.080 -12.312
  465    HE2  LYS  60           HE3      LYS  60  -2.212   0.136 -14.267
  466    HE3  LYS  60           HE2      LYS  60  -3.685   1.017 -13.864
  467    HZ1  LYS  60           HZ1      LYS  60  -1.770   1.849 -15.592
  468    HZ2  LYS  60           HZ2      LYS  60  -1.403   2.725 -14.194
  469    HZ3  LYS  60           HZ3      LYS  60  -2.943   2.838 -14.881
  470    H    GLU  61           H        GLU  61  -2.489   1.368 -10.078
  471    HA   GLU  61           HA       GLU  61  -4.060  -0.126  -8.298
  472    HB2  GLU  61           HB3      GLU  61  -4.458   2.046  -9.974
  473    HB3  GLU  61           HB2      GLU  61  -5.520   0.813 -10.641
  474    HG2  GLU  61           HG3      GLU  61  -5.795   0.830  -7.807
  475    HG3  GLU  61           HG2      GLU  61  -5.953   2.479  -8.411
  476    H    GLU  62           H        GLU  62  -3.862  -0.393 -11.854
  477    HA   GLU  62           HA       GLU  62  -5.446  -2.707 -12.050
  478    HB2  GLU  62           HB3      GLU  62  -4.970  -2.673 -14.299
  479    HB3  GLU  62           HB2      GLU  62  -4.607  -1.008 -13.867
  480    HG2  GLU  62           HG3      GLU  62  -2.220  -1.627 -13.669
  481    HG3  GLU  62           HG2      GLU  62  -2.629  -3.245 -14.235
  482    H    THR  63           H        THR  63  -1.931  -2.299 -11.843
  483    HA   THR  63           HA       THR  63  -1.258  -5.011 -12.189
  484    HB   THR  63           HB       THR  63   0.175  -2.603 -11.727
  485    HG1  THR  63           HG1      THR  63   1.490  -3.664 -12.948
  486   HG21  THR  63          HG21      THR  63   1.684  -2.918 -10.028
  487   HG22  THR  63          HG22      THR  63   1.391  -4.656  -9.943
  488   HG23  THR  63          HG23      THR  63   0.197  -3.528  -9.303
  489    H    LEU  64           H        LEU  64  -2.361  -3.188  -9.453
  490    HA   LEU  64           HA       LEU  64  -1.586  -5.064  -7.447
  491    HB2  LEU  64           HB3      LEU  64  -3.066  -2.548  -7.602
  492    HB3  LEU  64           HB2      LEU  64  -3.757  -3.660  -6.434
  493    HG   LEU  64           HG       LEU  64  -0.913  -2.649  -6.465
  494   HD11  LEU  64          HD11      LEU  64  -1.996  -0.889  -5.542
  495   HD12  LEU  64          HD12      LEU  64  -1.898  -1.901  -4.100
  496   HD13  LEU  64          HD13      LEU  64  -3.384  -1.859  -5.047
  497   HD21  LEU  64          HD21      LEU  64  -0.600  -3.876  -4.415
  498   HD22  LEU  64          HD22      LEU  64  -1.111  -4.989  -5.684
  499   HD23  LEU  64          HD23      LEU  64  -2.265  -4.455  -4.464
  500    H    MET  65           H        MET  65  -4.565  -4.618  -9.503
  501    HA   MET  65           HA       MET  65  -6.354  -6.306  -8.158
  502    HB2  MET  65           HB3      MET  65  -6.111  -5.533 -11.064
  503    HB3  MET  65           HB2      MET  65  -7.415  -6.550 -10.467
  504    HG2  MET  65           HG3      MET  65  -6.825  -3.695  -9.747
  505    HG3  MET  65           HG2      MET  65  -8.238  -4.334 -10.586
  506    HE1  MET  65           HE1      MET  65  -6.730  -3.193  -7.407
  507    HE2  MET  65           HE2      MET  65  -6.271  -4.870  -7.108
  508    HE3  MET  65           HE3      MET  65  -7.502  -4.099  -6.106
  509    H    GLU  66           H        GLU  66  -3.827  -6.932 -10.640
  510    HA   GLU  66           HA       GLU  66  -4.473  -9.733 -10.762
  511    HB2  GLU  66           HB3      GLU  66  -2.252  -9.777 -12.084
  512    HB3  GLU  66           HB2      GLU  66  -3.620  -8.917 -12.779
  513    HG2  GLU  66           HG3      GLU  66  -2.710  -6.803 -12.060
  514    HG3  GLU  66           HG2      GLU  66  -1.381  -7.623 -11.238
  515    H    TYR  67           H        TYR  67  -2.061  -7.716  -9.200
  516    HA   TYR  67           HA       TYR  67  -0.284  -9.750  -8.283
  517    HB2  TYR  67           HB3      TYR  67   0.708  -7.714  -7.995
  518    HB3  TYR  67           HB2      TYR  67  -0.808  -6.915  -7.596
  519    HD1  TYR  67           HD1      TYR  67   2.111  -8.636  -6.284
  520    HD2  TYR  67           HD2      TYR  67  -1.752  -6.996  -5.296
  521    HE1  TYR  67           HE1      TYR  67   2.718  -8.681  -3.902
  522    HE2  TYR  67           HE2      TYR  67  -1.154  -7.034  -2.910
  523    HH   TYR  67           HH       TYR  67   0.736  -7.195  -1.418
  524    H    LEU  68           H        LEU  68  -3.468  -8.730  -7.242
  525    HA   LEU  68           HA       LEU  68  -3.410  -9.569  -4.563
  526    HB2  LEU  68           HB3      LEU  68  -5.603  -9.242  -6.584
  527    HB3  LEU  68           HB2      LEU  68  -5.947  -9.899  -4.995
  528    HG   LEU  68           HG       LEU  68  -4.669  -7.205  -5.463
  529   HD11  LEU  68          HD11      LEU  68  -6.792  -6.210  -5.056
  530   HD12  LEU  68          HD12      LEU  68  -7.524  -7.774  -4.692
  531   HD13  LEU  68          HD13      LEU  68  -7.007  -7.403  -6.337
  532   HD21  LEU  68          HD21      LEU  68  -4.129  -8.159  -3.305
  533   HD22  LEU  68          HD22      LEU  68  -5.505  -7.299  -2.619
  534   HD23  LEU  68          HD23      LEU  68  -5.276  -6.836  -3.104
  535    H    GLU  69           H        GLU  69  -3.324 -11.361  -7.478
  536    HA   GLU  69           HA       GLU  69  -4.651 -13.721  -6.752
  537    HB2  GLU  69           HB3      GLU  69  -3.291 -12.833  -8.972
  538    HB3  GLU  69           HB2      GLU  69  -2.144 -14.133  -8.374
  539    HG2  GLU  69           HG3      GLU  69  -4.095 -15.684  -8.440
  540    HG3  GLU  69           HG2      GLU  69  -5.173 -14.404  -8.992
  541    H    ASN  70           H        ASN  70  -1.029 -13.640  -7.096
  542    HA   ASN  70           HA       ASN  70  -0.833 -15.206  -4.492
  543    HB2  ASN  70           HB3      ASN  70   0.562 -15.489  -7.217
  544    HB3  ASN  70           HB2      ASN  70   1.388 -16.006  -5.651
  545   HD21  ASN  70          HD21      ASN  70  -0.959 -16.788  -8.048
  546   HD22  ASN  70          HD22      ASN  70  -1.492 -18.312  -7.242
  547    HA   PRO  71           HA       PRO  71   1.192 -11.182  -3.524
  548    HB2  PRO  71           HB3      PRO  71   1.196 -12.636  -0.920
  549    HB3  PRO  71           HB2      PRO  71   0.767 -10.957  -1.271
  550    HG2  PRO  71           HG3      PRO  71  -1.125 -12.768  -0.800
  551    HG3  PRO  71           HG2      PRO  71  -1.348 -11.516  -2.037
  552    HD2  PRO  71           HD3      PRO  71  -0.722 -14.415  -2.361
  553    HD3  PRO  71           HD2      PRO  71  -1.708 -13.350  -3.385
  554    H    LYS  72           H        LYS  72   2.131 -14.485  -2.738
  555    HA   LYS  72           HA       LYS  72   4.854 -13.777  -2.130
  556    HB2  LYS  72           HB3      LYS  72   4.853 -15.789  -1.168
  557    HB3  LYS  72           HB2      LYS  72   3.199 -16.020  -1.718
  558    HG2  LYS  72           HG3      LYS  72   4.191 -17.869  -2.609
  559    HG3  LYS  72           HG2      LYS  72   4.382 -16.738  -3.949
  560    HD2  LYS  72           HD3      LYS  72   6.586 -16.445  -2.156
  561    HD3  LYS  72           HD2      LYS  72   6.392 -18.153  -2.559
  562    HE2  LYS  72           HE3      LYS  72   6.048 -16.708  -4.959
  563    HE3  LYS  72           HE2      LYS  72   7.451 -16.018  -4.154
  564    HZ1  LYS  72           HZ1      LYS  72   8.428 -18.211  -3.994
  565    HZ2  LYS  72           HZ2      LYS  72   8.051 -17.866  -5.607
  566    HZ3  LYS  72           HZ3      LYS  72   7.066 -18.910  -4.714
  567    H    LYS  73           H        LYS  73   3.044 -14.619  -4.940
  568    HA   LYS  73           HA       LYS  73   5.202 -15.544  -6.592
  569    HB2  LYS  73           HB3      LYS  73   3.681 -15.651  -8.328
  570    HB3  LYS  73           HB2      LYS  73   2.614 -15.748  -6.945
  571    HG2  LYS  73           HG3      LYS  73   1.485 -14.153  -8.049
  572    HG3  LYS  73           HG2      LYS  73   2.663 -13.083  -7.285
  573    HD2  LYS  73           HD3      LYS  73   2.275 -12.828  -9.807
  574    HD3  LYS  73           HD2      LYS  73   3.944 -12.912  -9.236
  575    HE2  LYS  73           HE3      LYS  73   3.406 -14.294 -11.267
  576    HE3  LYS  73           HE2      LYS  73   4.170 -15.160  -9.934
  577    HZ1  LYS  73           HZ1      LYS  73   1.836 -15.791  -9.251
  578    HZ2  LYS  73           HZ2      LYS  73   2.429 -16.528 -10.655
  579    HZ3  LYS  73           HZ3      LYS  73   1.333 -15.244 -10.772
  580    H    TYR  74           H        TYR  74   3.942 -12.380  -5.831
  581    HA   TYR  74           HA       TYR  74   5.431 -11.054  -7.917
  582    HB2  TYR  74           HB3      TYR  74   3.504 -10.258  -5.817
  583    HB3  TYR  74           HB2      TYR  74   4.690  -9.047  -6.271
  584    HD1  TYR  74           HD1      TYR  74   2.181 -11.355  -7.753
  585    HD2  TYR  74           HD2      TYR  74   4.327  -7.704  -8.139
  586    HE1  TYR  74           HE1      TYR  74   0.829 -10.776  -9.725
  587    HE2  TYR  74           HE2      TYR  74   2.982  -7.113 -10.111
  588    HH   TYR  74           HH       TYR  74   0.732  -9.383 -11.546
  589    H    ILE  75           H        ILE  75   5.690 -11.420  -4.422
  590    HA   ILE  75           HA       ILE  75   8.517 -10.637  -4.624
  591    HB   ILE  75           HB       ILE  75   6.504  -9.694  -2.513
  592   HG12  ILE  75          HG13      ILE  75   6.571  -8.140  -4.379
  593   HG13  ILE  75          HG12      ILE  75   7.754  -7.462  -3.264
  594   HG21  ILE  75          HG21      ILE  75   8.526  -8.628  -1.414
  595   HG22  ILE  75          HG22      ILE  75   9.502  -9.770  -2.337
  596   HG23  ILE  75          HG23      ILE  75   8.320 -10.361  -1.170
  597   HD11  ILE  75          HD11      ILE  75   9.058  -7.366  -5.072
  598   HD12  ILE  75          HD12      ILE  75   8.105  -8.565  -5.948
  599   HD13  ILE  75          HD13      ILE  75   9.315  -9.085  -4.774
  600    HA   PRO  76           HA       PRO  76   8.022 -14.851  -2.547
  601    HB2  PRO  76           HB3      PRO  76  10.718 -15.076  -3.765
  602    HB3  PRO  76           HB2      PRO  76   9.367 -16.214  -3.817
  603    HG2  PRO  76           HG3      PRO  76  10.030 -14.719  -6.049
  604    HG3  PRO  76           HG2      PRO  76   8.335 -15.057  -5.652
  605    HD2  PRO  76           HD3      PRO  76   9.917 -12.553  -5.242
  606    HD3  PRO  76           HD2      PRO  76   8.224 -12.749  -5.744
  607    H    GLY  77           H        GLY  77   8.675 -15.271  -0.527
  608    HA2  GLY  77           HA3      GLY  77  10.431 -15.478   1.112
  609    HA3  GLY  77           HA2      GLY  77  11.197 -14.065   0.403
  610    H    THR  78           H        THR  78   8.328 -12.900   0.289
  611    HA   THR  78           HA       THR  78   8.434 -11.816   3.012
  612    HB   THR  78           HB       THR  78   8.240 -10.548   0.579
  613    HG1  THR  78           HG1      THR  78   7.274  -9.525   3.038
  614   HG21  THR  78          HG21      THR  78   5.803 -11.340   0.554
  615   HG22  THR  78          HG22      THR  78   6.136  -9.636   0.248
  616   HG23  THR  78          HG23      THR  78   5.555 -10.150   1.831
  617    H    LYS  79           H        LYS  79   6.925 -12.277   4.468
  618    HA   LYS  79           HA       LYS  79   4.514 -13.699   3.566
  619    HB2  LYS  79           HB3      LYS  79   6.243 -14.704   5.252
  620    HB3  LYS  79           HB2      LYS  79   5.443 -13.656   6.416
  621    HG2  LYS  79           HG3      LYS  79   4.662 -16.110   6.141
  622    HG3  LYS  79           HG2      LYS  79   3.465 -14.825   6.321
  623    HD2  LYS  79           HD3      LYS  79   2.925 -16.449   4.526
  624    HD3  LYS  79           HD2      LYS  79   3.061 -14.791   3.953
  625    HE2  LYS  79           HE3      LYS  79   4.163 -16.446   2.466
  626    HE3  LYS  79           HE2      LYS  79   5.257 -15.208   3.080
  627    HZ1  LYS  79           HZ1      LYS  79   6.167 -17.499   3.145
  628    HZ2  LYS  79           HZ2      LYS  79   4.980 -17.910   4.277
  629    HZ3  LYS  79           HZ3      LYS  79   6.140 -16.739   4.657
  630    H    MET  80           H        MET  80   2.498 -13.003   4.144
  631    HA   MET  80           HA       MET  80   2.375 -10.351   5.407
  632    HB2  MET  80           HB3      MET  80   0.683 -11.751   3.377
  633    HB3  MET  80           HB2      MET  80  -0.050 -10.515   4.391
  634    HG2  MET  80           HG3      MET  80   2.463  -9.985   2.853
  635    HG3  MET  80           HG2      MET  80   0.873  -9.824   2.111
  636    HE1  MET  80           HE1      MET  80  -0.416  -8.224   2.055
  637    HE2  MET  80           HE2      MET  80   0.140  -6.574   2.337
  638    HE3  MET  80           HE3      MET  80  -0.965  -7.339   3.479
  639    H    ILE  81           H        ILE  81   2.065 -10.540   7.384
  640    HA   ILE  81           HA       ILE  81   0.422 -12.585   8.713
  641    HB   ILE  81           HB       ILE  81   2.510 -10.743   9.881
  642   HG12  ILE  81          HG13      ILE  81   3.428 -13.204  10.389
  643   HG13  ILE  81          HG12      ILE  81   2.516 -13.562   8.927
  644   HG21  ILE  81          HG21      ILE  81   1.487 -13.015  11.450
  645   HG22  ILE  81          HG22      ILE  81   0.363 -11.675  11.216
  646   HG23  ILE  81          HG23      ILE  81   1.934 -11.388  11.962
  647   HD11  ILE  81          HD11      ILE  81   4.568 -13.093   8.052
  648   HD12  ILE  81          HD12      ILE  81   4.944 -11.893   9.290
  649   HD13  ILE  81          HD13      ILE  81   3.822 -11.495   7.988
  650    H    PHE  82           H        PHE  82  -1.440 -12.034   9.650
  651    HA   PHE  82           HA       PHE  82  -3.091 -10.726  10.779
  652    HB2  PHE  82           HB3      PHE  82  -0.909  -9.267  11.351
  653    HB3  PHE  82           HB2      PHE  82  -1.633  -8.200  10.080
  654    HD1  PHE  82           HD1      PHE  82  -2.251  -9.588  13.414
  655    HD2  PHE  82           HD2      PHE  82  -3.649  -6.936  10.393
  656    HE1  PHE  82           HE1      PHE  82  -3.795  -8.576  15.030
  657    HE2  PHE  82           HE2      PHE  82  -5.190  -5.828  12.046
  658    HZ   PHE  82           HZ       PHE  82  -5.269  -6.646  14.368
  659    H    ALA  83           H        ALA  83  -4.757  -9.079  10.166
  660    HA   ALA  83           HA       ALA  83  -5.286  -7.626   8.094
  661    HB1  ALA  83           HB1      ALA  83  -6.000  -9.403   6.263
  662    HB2  ALA  83           HB2      ALA  83  -4.711 -10.335   7.024
  663    HB3  ALA  83           HB3      ALA  83  -4.364  -8.748   6.338
  664    H    GLY  84           H        GLY  84  -6.991  -7.210   9.530
  665    HA2  GLY  84           HA3      GLY  84  -9.006  -9.208  10.033
  666    HA3  GLY  84           HA2      GLY  84  -9.049  -7.529  10.550
  667    H    ILE  85           H        ILE  85  -8.388  -7.952   7.245
  668    HA   ILE  85           HA       ILE  85 -11.221  -7.607   6.535
  669    HB   ILE  85           HB       ILE  85  -8.929  -5.971   5.450
  670   HG12  ILE  85          HG13      ILE  85 -10.468  -5.581   7.738
  671   HG13  ILE  85          HG12      ILE  85  -9.495  -4.367   6.914
  672   HG21  ILE  85          HG21      ILE  85 -11.850  -5.918   4.707
  673   HG22  ILE  85          HG22      ILE  85 -10.542  -6.553   3.708
  674   HG23  ILE  85          HG23      ILE  85 -10.604  -4.832   4.093
  675   HD11  ILE  85          HD11      ILE  85 -11.620  -4.057   5.450
  676   HD12  ILE  85          HD12      ILE  85 -11.533  -3.328   7.053
  677   HD13  ILE  85          HD13      ILE  85 -12.434  -4.825   6.812
  678    H    LYS  86           H        LYS  86 -11.837  -8.401   4.523
  679    HA   LYS  86           HA       LYS  86  -9.835  -9.635   2.808
  680    HB2  LYS  86           HB3      LYS  86 -11.450 -11.745   2.853
  681    HB3  LYS  86           HB2      LYS  86 -10.110 -11.580   3.979
  682    HG2  LYS  86           HG3      LYS  86 -12.386 -10.300   5.104
  683    HG3  LYS  86           HG2      LYS  86 -12.857 -11.907   4.550
  684    HD2  LYS  86           HD3      LYS  86 -11.391 -12.974   5.977
  685    HD3  LYS  86           HD2      LYS  86 -10.324 -11.576   6.095
  686    HE2  LYS  86           HE3      LYS  86 -12.432 -10.481   7.226
  687    HE3  LYS  86           HE2      LYS  86 -12.862 -12.163   7.541
  688    HZ1  LYS  86           HZ1      LYS  86 -10.189 -11.117   8.236
  689    HZ2  LYS  86           HZ2      LYS  86 -10.984 -12.479   8.849
  690    HZ3  LYS  86           HZ3      LYS  86 -11.500 -10.927   9.289
  691    H    LYS  87           H        LYS  87 -13.236  -8.969   3.476
  692    HA   LYS  87           HA       LYS  87 -14.567  -9.553   1.237
  693    HB2  LYS  87           HB3      LYS  87 -14.891  -7.695   3.310
  694    HB3  LYS  87           HB2      LYS  87 -15.083  -6.772   1.825
  695    HG2  LYS  87           HG3      LYS  87 -17.170  -7.498   1.705
  696    HG3  LYS  87           HG2      LYS  87 -16.550  -9.132   1.463
  697    HD2  LYS  87           HD3      LYS  87 -16.384  -9.283   3.994
  698    HD3  LYS  87           HD2      LYS  87 -17.349  -7.806   4.042
  699    HE2  LYS  87           HE3      LYS  87 -18.666  -9.915   4.260
  700    HE3  LYS  87           HE2      LYS  87 -19.176  -8.874   2.942
  701    HZ1  LYS  87           HZ1      LYS  87 -18.885 -11.399   2.549
  702    HZ2  LYS  87           HZ2      LYS  87 -17.228 -11.030   2.436
  703    HZ3  LYS  87           HZ3      LYS  87 -18.341 -10.310   1.375
  704    H    LYS  88           H        LYS  88 -14.091  -9.396  -0.849
  705    HA   LYS  88           HA       LYS  88 -12.045  -7.961  -1.991
  706    HB2  LYS  88           HB3      LYS  88 -13.200  -9.753  -3.166
  707    HB3  LYS  88           HB2      LYS  88 -14.665  -8.783  -3.253
  708    HG2  LYS  88           HG3      LYS  88 -13.663  -7.221  -4.867
  709    HG3  LYS  88           HG2      LYS  88 -12.057  -7.908  -4.607
  710    HD2  LYS  88           HD3      LYS  88 -14.267  -8.844  -6.313
  711    HD3  LYS  88           HD2      LYS  88 -12.524  -9.034  -6.507
  712    HE2  LYS  88           HE3      LYS  88 -13.480 -11.201  -6.160
  713    HE3  LYS  88           HE2      LYS  88 -12.588 -10.799  -4.622
  714    HZ1  LYS  88           HZ1      LYS  88 -15.226 -11.596  -4.765
  715    HZ2  LYS  88           HZ2      LYS  88 -15.278  -9.942  -4.413
  716    HZ3  LYS  88           HZ3      LYS  88 -14.414 -10.991  -3.409
  717    H    THR  89           H        THR  89 -15.368  -6.954  -1.416
  718    HA   THR  89           HA       THR  89 -15.201  -4.471  -2.944
  719    HB   THR  89           HB       THR  89 -17.349  -4.088  -2.086
  720    HG1  THR  89           HG1      THR  89 -17.243  -3.889   0.038
  721   HG21  THR  89          HG21      THR  89 -17.222  -7.026  -1.481
  722   HG22  THR  89          HG22      THR  89 -17.273  -6.359  -3.114
  723   HG23  THR  89          HG23      THR  89 -18.619  -6.088  -2.007
  724    H    GLU  90           H        GLU  90 -14.302  -5.414   0.366
  725    HA   GLU  90           HA       GLU  90 -14.076  -2.760   1.413
  726    HB2  GLU  90           HB3      GLU  90 -12.826  -5.313   2.444
  727    HB3  GLU  90           HB2      GLU  90 -13.030  -3.816   3.342
  728    HG2  GLU  90           HG3      GLU  90 -15.489  -4.972   2.214
  729    HG3  GLU  90           HG2      GLU  90 -14.711  -5.907   3.490
  730    H    ARG  91           H        ARG  91 -11.791  -5.192   0.244
  731    HA   ARG  91           HA       ARG  91  -9.437  -3.706   0.631
  732    HB2  ARG  91           HB3      ARG  91  -9.952  -5.929  -1.288
  733    HB3  ARG  91           HB2      ARG  91  -8.412  -5.087  -1.167
  734    HG2  ARG  91           HG3      ARG  91  -8.846  -5.700   1.427
  735    HG3  ARG  91           HG2      ARG  91  -9.639  -7.069   0.624
  736    HD2  ARG  91           HD3      ARG  91  -7.002  -6.876  -0.665
  737    HD3  ARG  91           HD2      ARG  91  -6.894  -6.597   1.071
  738    HE   ARG  91           HE       ARG  91  -8.214  -8.721   1.116
  739   HH11  ARG  91          HH11      ARG  91  -5.833  -7.779  -1.244
  740   HH12  ARG  91          HH12      ARG  91  -5.293  -9.329  -1.516
  741   HH21  ARG  91          HH21      ARG  91  -7.529 -10.861   0.720
  742   HH22  ARG  91          HH22      ARG  91  -6.272 -11.162  -0.418
  743    H    GLU  92           H        GLU  92 -11.468  -4.145  -2.320
  744    HA   GLU  92           HA       GLU  92  -9.990  -2.484  -4.011
  745    HB2  GLU  92           HB3      GLU  92 -11.838  -4.082  -4.662
  746    HB3  GLU  92           HB2      GLU  92 -12.983  -2.860  -4.123
  747    HG2  GLU  92           HG3      GLU  92 -12.737  -2.730  -6.503
  748    HG3  GLU  92           HG2      GLU  92 -12.034  -1.291  -5.767
  749    H    ASP  93           H        ASP  93 -12.610  -1.746  -1.759
  750    HA   ASP  93           HA       ASP  93 -13.070   0.909  -2.507
  751    HB2  ASP  93           HB3      ASP  93 -14.634  -0.082  -1.030
  752    HB3  ASP  93           HB2      ASP  93 -13.386  -0.566   0.171
  753    H    GLY  94           H        GLY  94 -10.835  -0.466  -0.045
  754    HA2  GLY  94           HA3      GLY  94  -9.776   2.012   0.910
  755    HA3  GLY  94           HA2      GLY  94  -8.939   0.467   0.947
  756    H    ILE  95           H        ILE  95  -8.952   0.032  -1.976
  757    HA   ILE  95           HA       ILE  95  -6.548   1.298  -2.660
  758    HB   ILE  95           HB       ILE  95  -8.522  -0.396  -4.069
  759   HG12  ILE  95          HG13      ILE  95  -5.525  -0.371  -3.727
  760   HG13  ILE  95          HG12      ILE  95  -6.685  -1.434  -2.933
  761   HG21  ILE  95          HG21      ILE  95  -8.377   0.666  -6.020
  762   HG22  ILE  95          HG22      ILE  95  -6.692   0.152  -6.067
  763   HG23  ILE  95          HG23      ILE  95  -7.111   1.741  -5.428
  764   HD11  ILE  95          HD11      ILE  95  -6.352  -1.414  -5.906
  765   HD12  ILE  95          HD12      ILE  95  -7.063  -2.656  -4.875
  766   HD13  ILE  95          HD13      ILE  95  -5.322  -2.383  -4.851
  767    H    ALA  96           H        ALA  96  -9.910   2.086  -3.436
  768    HA   ALA  96           HA       ALA  96  -9.422   4.102  -5.338
  769    HB1  ALA  96           HB1      ALA  96 -11.683   3.223  -4.923
  770    HB2  ALA  96           HB2      ALA  96 -11.634   4.990  -4.656
  771    HB3  ALA  96           HB3      ALA  96 -11.648   3.928  -3.258
  772    H    TYR  97           H        TYR  97  -9.719   4.360  -1.787
  773    HA   TYR  97           HA       TYR  97  -9.303   7.130  -1.575
  774    HB2  TYR  97           HB3      TYR  97 -10.128   6.003   0.348
  775    HB3  TYR  97           HB2      TYR  97  -8.807   4.842   0.331
  776    HD1  TYR  97           HD1      TYR  97  -7.873   5.111   2.517
  777    HD2  TYR  97           HD2      TYR  97  -8.573   8.537   0.006
  778    HE1  TYR  97           HE1      TYR  97  -6.623   6.510   4.105
  779    HE2  TYR  97           HE2      TYR  97  -7.324   9.946   1.587
  780    HH   TYR  97           HH       TYR  97  -5.515   8.586   4.228
  781    H    LEU  98           H        LEU  98  -7.107   4.402  -1.768
  782    HA   LEU  98           HA       LEU  98  -4.707   5.744  -1.175
  783    HB2  LEU  98           HB3      LEU  98  -5.475   3.153  -1.844
  784    HB3  LEU  98           HB2      LEU  98  -4.415   3.634  -3.152
  785    HG   LEU  98           HG       LEU  98  -3.639   3.830  -0.246
  786   HD11  LEU  98          HD11      LEU  98  -2.165   1.790  -1.348
  787   HD12  LEU  98          HD12      LEU  98  -3.774   1.520  -2.019
  788   HD13  LEU  98          HD13      LEU  98  -3.549   1.599  -0.272
  789   HD21  LEU  98          HD21      LEU  98  -2.135   4.053  -2.834
  790   HD22  LEU  98          HD22      LEU  98  -1.344   3.837  -1.282
  791   HD23  LEU  98          HD23      LEU  98  -2.317   5.277  -1.582
  792    H    LYS  99           H        LYS  99  -6.551   5.376  -4.138
  793    HA   LYS  99           HA       LYS  99  -4.640   6.234  -5.984
  794    HB2  LYS  99           HB3      LYS  99  -7.594   6.828  -6.161
  795    HB3  LYS  99           HB2      LYS  99  -6.456   6.627  -7.488
  796    HG2  LYS  99           HG3      LYS  99  -7.404   4.484  -5.599
  797    HG3  LYS  99           HG2      LYS  99  -7.854   4.676  -7.294
  798    HD2  LYS  99           HD3      LYS  99  -6.097   2.876  -6.569
  799    HD3  LYS  99           HD2      LYS  99  -5.228   4.571  -7.621
  800    HE2  LYS  99           HE3      LYS  99  -4.036   3.838  -5.896
  801    HE3  LYS  99           HE2      LYS  99  -5.474   3.985  -4.887
  802    HZ1  LYS  99           HZ1      LYS  99  -4.142   1.604  -5.652
  803    HZ2  LYS  99           HZ2      LYS  99  -5.655   1.559  -6.403
  804    HZ3  LYS  99           HZ3      LYS  99  -5.551   1.742  -4.726
  805    H    LYS 100           H        LYS 100  -6.957   8.047  -4.054
  806    HA   LYS 100           HA       LYS 100  -6.116  10.562  -5.153
  807    HB2  LYS 100           HB3      LYS 100  -8.177  11.011  -4.382
  808    HB3  LYS 100           HB2      LYS 100  -8.164   9.605  -3.329
  809    HG2  LYS 100           HG3      LYS 100  -6.841  10.907  -1.686
  810    HG3  LYS 100           HG2      LYS 100  -7.022  12.321  -2.725
  811    HD2  LYS 100           HD3      LYS 100  -9.190  10.786  -1.305
  812    HD3  LYS 100           HD2      LYS 100  -8.701  12.460  -1.040
  813    HE2  LYS 100           HE3      LYS 100  -9.773  11.495  -3.676
  814    HE3  LYS 100           HE2      LYS 100 -10.827  12.072  -2.387
  815    HZ1  LYS 100           HZ1      LYS 100  -9.389  13.577  -4.264
  816    HZ2  LYS 100           HZ2      LYS 100  -8.787  13.945  -2.727
  817    HZ3  LYS 100           HZ3      LYS 100 -10.436  14.130  -3.055
  818    H    ALA 101           H        ALA 101  -5.488   8.736  -2.303
  819    HA   ALA 101           HA       ALA 101  -4.116  10.565  -0.737
  820    HB1  ALA 101           HB1      ALA 101  -3.341   7.677  -0.794
  821    HB2  ALA 101           HB2      ALA 101  -4.926   8.168  -0.199
  822    HB3  ALA 101           HB3      ALA 101  -3.464   8.774   0.582
  823    H    THR 102           H        THR 102  -3.127   8.819  -3.550
  824    HA   THR 102           HA       THR 102  -0.352   9.705  -3.158
  825    HB   THR 102           HB       THR 102  -0.282   7.438  -3.769
  826    HG1  THR 102           HG1      THR 102   0.854   7.595  -5.532
  827   HG21  THR 102          HG21      THR 102  -2.775   8.004  -5.159
  828   HG22  THR 102          HG22      THR 102  -2.189   6.508  -4.433
  829   HG23  THR 102          HG23      THR 102  -1.684   6.955  -6.063
  830    H    ASN 103           H        ASN 103  -3.331  10.299  -4.844
  831    HA   ASN 103           HA       ASN 103  -2.330  12.717  -6.008
  832    HB2  ASN 103           HB3      ASN 103  -3.711  11.022  -8.022
  833    HB3  ASN 103           HB2      ASN 103  -2.472  12.252  -8.248
  834   HD21  ASN 103          HD21      ASN 103  -3.061   8.938  -7.277
  835   HD22  ASN 103          HD22      ASN 103  -1.463   8.362  -7.586
  836    H    GLU 104           H        GLU 104  -3.818  14.034  -5.246
  837    HA   GLU 104           HA       GLU 104  -6.244  14.574  -6.133
  838    HB2  GLU 104           HB3      GLU 104  -6.410  12.193  -4.359
  839    HB3  GLU 104           HB2      GLU 104  -7.697  13.383  -4.260
  840    HG2  GLU 104           HG3      GLU 104  -7.031  12.645  -6.995
  841    HG3  GLU 104           HG2      GLU 104  -7.580  11.285  -6.016
  842    HHA  HEC 201           HHA      HEC 201   5.075  -5.121   0.590
  843    HHB  HEC 201           HHB      HEC 201  -0.513  -2.431   0.406
  844    HHC  HEC 201           HHC      HEC 201  -2.148  -6.087   5.286
  845    HHD  HEC 201           HHD      HEC 201   3.975  -5.819   6.901
  846   HMA1  HEC 201          HMA1      HEC 201   0.832  -1.134  -1.160
  847   HMA2  HEC 201          HMA2      HEC 201   2.434  -0.293  -0.641
  848   HMA3  HEC 201          HMA3      HEC 201   2.247  -1.563  -1.462
  849   HAA1  HEC 201          HAA1      HEC 201   4.918  -2.995  -1.318
  850   HAA2  HEC 201          HAA2      HEC 201   5.501  -2.357   0.228
  851   HBA1  HEC 201          HBA1      HEC 201   4.026  -0.319  -0.188
  852   HBA2  HEC 201          HBA2      HEC 201   3.766  -0.950  -1.827
  853   HMB1  HEC 201          HMB1      HEC 201  -3.694  -1.926   2.093
  854   HMB2  HEC 201          HMB2      HEC 201  -3.772  -3.210   0.870
  855   HMB3  HEC 201          HMB3      HEC 201  -2.509  -1.955   0.764
  856    HAB  HEC 201           HAB      HEC 201  -4.006  -3.256   4.598
  857   HBB1  HEC 201          HBB1      HEC 201  -5.438  -5.228   2.806
  858   HBB2  HEC 201          HBB2      HEC 201  -4.794  -3.733   2.097
  859   HBB3  HEC 201          HBB3      HEC 201  -5.916  -3.651   3.484
  860   HMC1  HEC 201          HMC1      HEC 201  -1.018  -7.543   8.630
  861   HMC2  HEC 201          HMC2      HEC 201  -2.002  -7.684   7.032
  862   HMC3  HEC 201          HMC3      HEC 201  -0.655  -8.303   7.377
  863    HAC  HEC 201           HAC      HEC 201   2.909  -6.829   8.384
  864   HBC1  HEC 201          HBC1      HEC 201   3.182  -9.217   7.827
  865   HBC2  HEC 201          HBC2      HEC 201   1.530  -9.526   8.399
  866   HBC3  HEC 201          HBC3      HEC 201   2.783  -8.976   9.546
  867   HMD1  HEC 201          HMD1      HEC 201   5.904  -7.013   6.505
  868   HMD2  HEC 201          HMD2      HEC 201   7.047  -5.716   6.105
  869   HMD3  HEC 201          HMD3      HEC 201   7.148  -7.285   5.258
  870   HAD1  HEC 201          HAD1      HEC 201   7.856  -6.296   3.283
  871   HAD2  HEC 201          HAD2      HEC 201   7.449  -4.874   2.308
  872   HBD1  HEC 201          HBD1      HEC 201   7.769  -7.539   1.426
  873   HBD2  HEC 201          HBD2      HEC 201   7.230  -6.138   0.479
  Start of MODEL    8
    1    H1   GLY   1          1H        GLY   1 -19.429   4.051  -0.410
    2    H2   GLY   1          2H        GLY   1 -18.822   3.525  -1.897
    3    H3   GLY   1          3H        GLY   1 -18.992   5.179  -1.594
    4    HA2  GLY   1           HA2      GLY   1 -17.358   3.810   0.343
    5    HA3  GLY   1           HA3      GLY   1 -16.707   3.771  -1.289
    6    H    ASP   2           H        ASP   2 -16.570   5.301   1.554
    7    HA   ASP   2           HA       ASP   2 -15.992   7.847   0.223
    8    HB2  ASP   2           HB3      ASP   2 -16.593   7.569   3.124
    9    HB3  ASP   2           HB2      ASP   2 -16.640   9.018   2.168
   10    H    VAL   3           H        VAL   3 -14.222   9.116   1.093
   11    HA   VAL   3           HA       VAL   3 -11.865   7.617   1.411
   12    HB   VAL   3           HB       VAL   3 -12.556  10.502   1.545
   13   HG11  VAL   3          HG11      VAL   3 -11.226  10.575   3.444
   14   HG12  VAL   3          HG12      VAL   3 -10.072  10.892   2.149
   15   HG13  VAL   3          HG13      VAL   3 -10.166   9.286   2.873
   16   HG21  VAL   3          HG21      VAL   3 -11.804  10.224  -0.538
   17   HG22  VAL   3          HG22      VAL   3 -11.080   8.661  -0.155
   18   HG23  VAL   3          HG23      VAL   3 -10.191  10.150   0.172
   19    H    GLU   4           H        GLU   4 -13.897   9.339   3.729
   20    HA   GLU   4           HA       GLU   4 -12.254   9.079   5.957
   21    HB2  GLU   4           HB3      GLU   4 -14.173  10.546   5.989
   22    HB3  GLU   4           HB2      GLU   4 -15.266   9.191   5.741
   23    HG2  GLU   4           HG3      GLU   4 -14.372   8.287   7.949
   24    HG3  GLU   4           HG2      GLU   4 -13.683   9.891   8.188
   25    H    LYS   5           H        LYS   5 -14.794   6.936   4.709
   26    HA   LYS   5           HA       LYS   5 -14.616   5.017   6.769
   27    HB2  LYS   5           HB3      LYS   5 -15.486   4.582   3.905
   28    HB3  LYS   5           HB2      LYS   5 -15.874   3.560   5.281
   29    HG2  LYS   5           HG3      LYS   5 -16.783   6.015   6.090
   30    HG3  LYS   5           HG2      LYS   5 -17.134   6.015   4.360
   31    HD2  LYS   5           HD3      LYS   5 -17.802   3.515   5.743
   32    HD3  LYS   5           HD2      LYS   5 -18.734   4.919   6.271
   33    HE2  LYS   5           HE3      LYS   5 -20.005   4.755   4.461
   34    HE3  LYS   5           HE2      LYS   5 -18.586   4.996   3.444
   35    HZ1  LYS   5           HZ1      LYS   5 -20.111   2.659   3.801
   36    HZ2  LYS   5           HZ2      LYS   5 -18.533   2.360   4.331
   37    HZ3  LYS   5           HZ3      LYS   5 -18.803   2.918   2.758
   38    H    GLY   6           H        GLY   6 -12.946   5.383   3.687
   39    HA2  GLY   6           HA3      GLY   6 -11.677   2.869   3.626
   40    HA3  GLY   6           HA2      GLY   6 -11.114   4.318   2.810
   41    H    LYS   7           H        LYS   7 -10.662   5.961   5.001
   42    HA   LYS   7           HA       LYS   7  -8.069   5.243   5.655
   43    HB2  LYS   7           HB3      LYS   7  -8.478   7.511   5.873
   44    HB3  LYS   7           HB2      LYS   7  -9.994   7.260   6.730
   45    HG2  LYS   7           HG3      LYS   7  -7.836   6.209   8.286
   46    HG3  LYS   7           HG2      LYS   7  -7.475   7.871   7.809
   47    HD2  LYS   7           HD3      LYS   7 -10.151   7.931   8.549
   48    HD3  LYS   7           HD2      LYS   7  -9.394   6.870   9.738
   49    HE2  LYS   7           HE3      LYS   7  -8.886   8.788  10.790
   50    HE3  LYS   7           HE2      LYS   7  -7.580   8.879   9.609
   51    HZ1  LYS   7           HZ1      LYS   7  -8.505  10.899   9.273
   52    HZ2  LYS   7           HZ2      LYS   7 -10.050  10.419   9.768
   53    HZ3  LYS   7           HZ3      LYS   7  -9.498  10.023   8.219
   54    H    LYS   8           H        LYS   8 -10.829   4.956   7.520
   55    HA   LYS   8           HA       LYS   8  -9.875   3.840   9.932
   56    HB2  LYS   8           HB3      LYS   8 -12.012   4.583  10.226
   57    HB3  LYS   8           HB2      LYS   8 -12.508   4.128   8.603
   58    HG2  LYS   8           HG3      LYS   8 -11.902   1.923  10.473
   59    HG3  LYS   8           HG2      LYS   8 -13.357   2.868  10.791
   60    HD2  LYS   8           HD3      LYS   8 -14.268   2.348   8.667
   61    HD3  LYS   8           HD2      LYS   8 -12.731   1.700   8.090
   62    HE2  LYS   8           HE3      LYS   8 -13.977   0.452  10.484
   63    HE3  LYS   8           HE2      LYS   8 -14.691   0.122   8.905
   64    HZ1  LYS   8           HZ1      LYS   8 -11.810  -0.251   9.493
   65    HZ2  LYS   8           HZ2      LYS   8 -12.662  -0.786   8.133
   66    HZ3  LYS   8           HZ3      LYS   8 -12.954  -1.488   9.643
   67    H    ILE   9           H        ILE   9 -10.979   2.403   6.903
   68    HA   ILE   9           HA       ILE   9 -11.010  -0.279   7.733
   69    HB   ILE   9           HB       ILE   9 -10.805   1.080   5.087
   70   HG12  ILE   9          HG13      ILE   9 -12.650  -1.060   6.177
   71   HG13  ILE   9          HG12      ILE   9 -12.985   0.669   6.195
   72   HG21  ILE   9          HG21      ILE   9 -10.540  -1.870   5.358
   73   HG22  ILE   9          HG22      ILE   9  -9.164  -0.834   5.106
   74   HG23  ILE   9          HG23      ILE   9 -10.431  -0.923   3.881
   75   HD11  ILE   9          HD11      ILE   9 -13.146  -1.236   4.016
   76   HD12  ILE   9          HD12      ILE   9 -12.491   0.308   3.576
   77   HD13  ILE   9          HD13      ILE   9 -14.092   0.189   4.306
   78    H    PHE  10           H        PHE  10  -8.451   1.681   6.260
   79    HA   PHE  10           HA       PHE  10  -6.509  -0.367   6.112
   80    HB2  PHE  10           HB3      PHE  10  -5.918   1.406   4.778
   81    HB3  PHE  10           HB2      PHE  10  -6.503   2.605   5.926
   82    HD1  PHE  10           HD1      PHE  10  -3.659   1.346   4.434
   83    HD2  PHE  10           HD2      PHE  10  -5.123   2.549   8.245
   84    HE1  PHE  10           HE1      PHE  10  -1.351   1.736   5.193
   85    HE2  PHE  10           HE2      PHE  10  -2.817   2.942   9.012
   86    HZ   PHE  10           HZ       PHE  10  -0.928   2.535   7.484
   87    H    VAL  11           H        VAL  11  -7.350   1.960   8.602
   88    HA   VAL  11           HA       VAL  11  -5.179   1.791  10.274
   89    HB   VAL  11           HB       VAL  11  -8.097   2.045  10.991
   90   HG11  VAL  11          HG11      VAL  11  -5.647   2.229  12.719
   91   HG12  VAL  11          HG12      VAL  11  -7.106   1.272  12.978
   92   HG13  VAL  11          HG13      VAL  11  -7.160   3.027  13.145
   93   HG21  VAL  11          HG21      VAL  11  -6.213   3.816   9.834
   94   HG22  VAL  11          HG22      VAL  11  -6.546   4.382  11.471
   95   HG23  VAL  11          HG23      VAL  11  -7.871   4.151  10.329
   96    H    GLN  12           H        GLN  12  -8.043  -0.375  10.317
   97    HA   GLN  12           HA       GLN  12  -6.739  -2.104  12.336
   98    HB2  GLN  12           HB3      GLN  12  -9.079  -3.275  11.120
   99    HB3  GLN  12           HB2      GLN  12  -8.825  -2.872  12.793
  100    HG2  GLN  12           HG3      GLN  12  -9.202  -0.390  11.643
  101    HG3  GLN  12           HG2      GLN  12 -10.259  -1.413  10.669
  102   HE21  GLN  12          HE21      GLN  12 -12.021  -0.262  11.600
  103   HE22  GLN  12          HE22      GLN  12 -12.640  -0.645  13.142
  104    H    LYS  13           H        LYS  13  -7.825  -2.177   9.195
  105    HA   LYS  13           HA       LYS  13  -7.332  -4.067   7.697
  106    HB2  LYS  13           HB3      LYS  13  -6.893  -1.352   7.436
  107    HB3  LYS  13           HB2      LYS  13  -5.400  -2.088   6.897
  108    HG2  LYS  13           HG3      LYS  13  -8.098  -2.086   5.645
  109    HG3  LYS  13           HG2      LYS  13  -6.473  -2.171   4.938
  110    HD2  LYS  13           HD3      LYS  13  -6.410  -4.550   5.757
  111    HD3  LYS  13           HD2      LYS  13  -8.123  -4.379   6.138
  112    HE2  LYS  13           HE3      LYS  13  -6.856  -4.901   3.629
  113    HE3  LYS  13           HE2      LYS  13  -8.540  -4.980   4.044
  114    HZ1  LYS  13           HZ1      LYS  13  -8.746  -2.624   3.634
  115    HZ2  LYS  13           HZ2      LYS  13  -8.062  -3.396   2.246
  116    HZ3  LYS  13           HZ3      LYS  13  -7.053  -2.489   3.319
  117    H    CYS  14           H        CYS  14  -4.596  -2.467   9.128
  118    HA   CYS  14           HA       CYS  14  -2.872  -4.447   9.527
  119    HB2  CYS  14           HB3      CYS  14  -1.513  -4.866   7.639
  120    HB3  CYS  14           HB2      CYS  14  -3.185  -5.530   7.487
  121    H    ALA  15           H        ALA  15  -3.469  -1.446   9.712
  122    HA   ALA  15           HA       ALA  15  -1.325  -0.122   8.530
  123    HB1  ALA  15           HB1      ALA  15  -2.556   0.723  11.139
  124    HB2  ALA  15           HB2      ALA  15  -3.389   0.874   9.593
  125    HB3  ALA  15           HB3      ALA  15  -1.880   1.744   9.871
  126    H    GLN  16           H        GLN  16  -1.414  -1.918  11.520
  127    HA   GLN  16           HA       GLN  16   0.764  -0.888  12.842
  128    HB2  GLN  16           HB3      GLN  16   0.471  -3.826  12.890
  129    HB3  GLN  16           HB2      GLN  16   0.545  -2.678  14.221
  130    HG2  GLN  16           HG3      GLN  16  -1.766  -2.048  13.549
  131    HG3  GLN  16           HG2      GLN  16  -1.773  -3.505  12.555
  132   HE21  GLN  16          HE21      GLN  16  -0.651  -2.701  15.808
  133   HE22  GLN  16          HE22      GLN  16  -1.445  -4.015  16.633
  134    H    CYS  17           H        CYS  17   0.538  -3.147  10.128
  135    HA   CYS  17           HA       CYS  17   3.339  -3.776  10.143
  136    HB2  CYS  17           HB3      CYS  17   1.520  -4.128   7.795
  137    HB3  CYS  17           HB2      CYS  17   2.910  -5.128   8.235
  138    H    HIS  18           H        HIS  18   1.409  -1.222   8.916
  139    HA   HIS  18           HA       HIS  18   3.614  -0.328   7.185
  140    HB2  HIS  18           HB3      HIS  18   0.704   0.474   7.116
  141    HB3  HIS  18           HB2      HIS  18   1.998   0.997   6.006
  142    HD1  HIS  18           HD1      HIS  18   1.675  -0.198   3.846
  143    HD2  HIS  18           HD2      HIS  18   0.772  -2.613   7.088
  144    HE1  HIS  18           HE1      HIS  18   1.096  -2.429   2.848
  145    H    THR  19           H        THR  19   3.119  -0.024  10.154
  146    HA   THR  19           HA       THR  19   3.293   1.561  11.791
  147    HB   THR  19           HB       THR  19   4.782   3.090   9.588
  148    HG1  THR  19           HG1      THR  19   6.569   1.977  10.361
  149   HG21  THR  19          HG21      THR  19   5.182   3.171  12.540
  150   HG22  THR  19          HG22      THR  19   4.267   4.396  11.642
  151   HG23  THR  19          HG23      THR  19   6.004   4.121  11.288
  152    H    VAL  20           H        VAL  20   2.657   3.738  12.457
  153    HA   VAL  20           HA       VAL  20   0.337   4.563  11.111
  154    HB   VAL  20           HB       VAL  20   1.356   5.899  13.577
  155   HG11  VAL  20          HG11      VAL  20  -0.687   6.553  12.228
  156   HG12  VAL  20          HG12      VAL  20  -0.727   6.516  14.030
  157   HG13  VAL  20          HG13      VAL  20  -1.426   5.187  13.093
  158   HG21  VAL  20          HG21      VAL  20   0.451   4.202  14.964
  159   HG22  VAL  20          HG22      VAL  20   1.551   3.466  13.932
  160   HG23  VAL  20          HG23      VAL  20  -0.067   3.290  13.547
  161    H    GLU  21           H        GLU  21   1.337   7.234  12.458
  162    HA   GLU  21           HA       GLU  21   1.554   8.648  10.091
  163    HB2  GLU  21           HB3      GLU  21   1.921  10.249  12.479
  164    HB3  GLU  21           HB2      GLU  21   0.776  10.459  11.194
  165    HG2  GLU  21           HG3      GLU  21  -0.637   8.807  12.234
  166    HG3  GLU  21           HG2      GLU  21   0.500   8.613  13.528
  167    H    LYS  22           H        LYS  22   3.370   9.791   9.490
  168    HA   LYS  22           HA       LYS  22   5.795   8.652  10.011
  169    HB2  LYS  22           HB3      LYS  22   5.100  10.301   8.166
  170    HB3  LYS  22           HB2      LYS  22   5.562  11.585   9.320
  171    HG2  LYS  22           HG3      LYS  22   7.360   9.446   8.165
  172    HG3  LYS  22           HG2      LYS  22   7.396  11.209   7.881
  173    HD2  LYS  22           HD3      LYS  22   7.926   9.786  10.487
  174    HD3  LYS  22           HD2      LYS  22   9.160  10.534   9.480
  175    HE2  LYS  22           HE3      LYS  22   8.196  12.696   9.864
  176    HE3  LYS  22           HE2      LYS  22   6.867  11.985  10.739
  177    HZ1  LYS  22           HZ1      LYS  22   9.366  12.767  11.785
  178    HZ2  LYS  22           HZ2      LYS  22   9.233  11.089  11.962
  179    HZ3  LYS  22           HZ3      LYS  22   8.030  12.121  12.598
  180    H    GLY  23           H        GLY  23   7.059   8.593  11.766
  181    HA2  GLY  23           HA3      GLY  23   8.220  10.463  13.209
  182    HA3  GLY  23           HA2      GLY  23   6.573  10.555  13.935
  183    H    GLY  24           H        GLY  24   6.136   7.663  13.531
  184    HA2  GLY  24           HA3      GLY  24   7.302   6.827  16.022
  185    HA3  GLY  24           HA2      GLY  24   6.219   5.897  15.009
  186    H    LYS  25           H        LYS  25   7.119   4.017  14.544
  187    HA   LYS  25           HA       LYS  25  10.002   4.014  13.813
  188    HB2  LYS  25           HB3      LYS  25   8.832   1.356  14.272
  189    HB3  LYS  25           HB2      LYS  25  10.232   2.116  15.022
  190    HG2  LYS  25           HG3      LYS  25   9.110   2.869  16.846
  191    HG3  LYS  25           HG2      LYS  25   7.603   3.056  15.928
  192    HD2  LYS  25           HD3      LYS  25   8.827   0.442  16.825
  193    HD3  LYS  25           HD2      LYS  25   7.434   1.264  17.543
  194    HE2  LYS  25           HE3      LYS  25   6.072   0.276  16.089
  195    HE3  LYS  25           HE2      LYS  25   7.020   0.963  14.722
  196    HZ1  LYS  25           HZ1      LYS  25   7.055  -1.735  15.778
  197    HZ2  LYS  25           HZ2      LYS  25   8.608  -1.044  15.546
  198    HZ3  LYS  25           HZ3      LYS  25   7.496  -1.134  14.233
  199    H    HIS  26           H        HIS  26  10.691   2.612  12.137
  200    HA   HIS  26           HA       HIS  26   9.087   2.858   9.865
  201    HB2  HIS  26           HB3      HIS  26  10.987   0.760   9.477
  202    HB3  HIS  26           HB2      HIS  26  11.064   2.393   8.832
  203    HD1  HIS  26           HD1      HIS  26  11.806   0.763  12.203
  204    HD2  HIS  26           HD2      HIS  26  13.328   3.614   9.617
  205    HE1  HIS  26           HE1      HIS  26  13.876   1.578  13.324
  206    HE2  HIS  26           HE2      HIS  26  14.730   3.376  11.758
  207    H    LYS  27           H        LYS  27   7.755   1.414   8.649
  208    HA   LYS  27           HA       LYS  27   6.691  -0.810  10.192
  209    HB2  LYS  27           HB3      LYS  27   4.834  -0.679   8.870
  210    HB3  LYS  27           HB2      LYS  27   5.434   0.949   8.770
  211    HG2  LYS  27           HG3      LYS  27   6.763  -0.326   6.709
  212    HG3  LYS  27           HG2      LYS  27   5.120  -0.967   6.667
  213    HD2  LYS  27           HD3      LYS  27   5.564   1.163   5.299
  214    HD3  LYS  27           HD2      LYS  27   4.101   1.051   6.308
  215    HE2  LYS  27           HE3      LYS  27   4.775   2.811   7.543
  216    HE3  LYS  27           HE2      LYS  27   6.397   2.072   7.772
  217    HZ1  LYS  27           HZ1      LYS  27   7.178   3.056   5.823
  218    HZ2  LYS  27           HZ2      LYS  27   6.319   4.288   6.640
  219    HZ3  LYS  27           HZ3      LYS  27   5.591   3.494   5.285
  220    H    THR  28           H        THR  28   6.107  -2.817   8.808
  221    HA   THR  28           HA       THR  28   8.503  -4.015   8.000
  222    HB   THR  28           HB       THR  28   5.872  -5.251   7.263
  223    HG1  THR  28           HG1      THR  28   6.701  -5.275   9.952
  224   HG21  THR  28          HG21      THR  28   6.830  -7.197   7.849
  225   HG22  THR  28          HG22      THR  28   8.050  -6.508   8.928
  226   HG23  THR  28          HG23      THR  28   8.222  -6.332   7.195
  227    H    GLY  29           H        GLY  29   5.764  -2.686   6.265
  228    HA2  GLY  29           HA3      GLY  29   7.359  -2.851   3.782
  229    HA3  GLY  29           HA2      GLY  29   5.661  -3.398   3.776
  230    HA   PRO  30           HA       PRO  30   6.532   1.432   3.021
  231    HB2  PRO  30           HB3      PRO  30   5.472   0.388   0.503
  232    HB3  PRO  30           HB2      PRO  30   6.560   1.698   0.805
  233    HG2  PRO  30           HG3      PRO  30   7.489  -0.624  -0.085
  234    HG3  PRO  30           HG2      PRO  30   8.365   0.290   1.101
  235    HD2  PRO  30           HD3      PRO  30   6.810  -2.166   1.384
  236    HD3  PRO  30           HD2      PRO  30   8.208  -1.580   2.307
  237    H    ASN  31           H        ASN  31   4.917   2.468   3.938
  238    HA   ASN  31           HA       ASN  31   2.353   1.444   4.355
  239    HB2  ASN  31           HB3      ASN  31   3.657   3.569   5.292
  240    HB3  ASN  31           HB2      ASN  31   2.702   4.435   4.090
  241   HD21  ASN  31          HD21      ASN  31   2.002   5.343   6.287
  242   HD22  ASN  31          HD22      ASN  31   0.702   4.635   7.011
  243    H    LEU  32           H        LEU  32   3.228   3.993   2.116
  244    HA   LEU  32           HA       LEU  32   1.722   2.951   0.074
  245    HB2  LEU  32           HB3      LEU  32  -0.175   4.460  -0.189
  246    HB3  LEU  32           HB2      LEU  32  -0.211   3.500   1.280
  247    HG   LEU  32           HG       LEU  32  -1.261   5.629   1.843
  248   HD11  LEU  32          HD11      LEU  32   1.403   5.257   2.784
  249   HD12  LEU  32          HD12      LEU  32  -0.024   4.576   3.563
  250   HD13  LEU  32          HD13      LEU  32   0.243   6.318   3.584
  251   HD21  LEU  32          HD21      LEU  32  -0.488   7.591   1.081
  252   HD22  LEU  32          HD22      LEU  32   0.182   6.515  -0.145
  253   HD23  LEU  32          HD23      LEU  32   1.173   7.033   1.225
  254    H    HIS  33           H        HIS  33   3.246   5.679   1.588
  255    HA   HIS  33           HA       HIS  33   3.290   7.616  -0.361
  256    HB2  HIS  33           HB3      HIS  33   4.615   7.163   2.028
  257    HB3  HIS  33           HB2      HIS  33   5.926   7.298   0.860
  258    HD1  HIS  33           HD1      HIS  33   6.580   9.589   2.016
  259    HD2  HIS  33           HD2      HIS  33   2.755   9.495   0.299
  260    HE1  HIS  33           HE1      HIS  33   5.850  11.992   1.897
  261    HE2  HIS  33           HE2      HIS  33   3.518  11.901   0.903
  262    H    GLY  34           H        GLY  34   4.022   7.687  -2.417
  263    HA2  GLY  34           HA3      GLY  34   5.322   7.292  -4.277
  264    HA3  GLY  34           HA2      GLY  34   6.494   6.521  -3.185
  265    H    LEU  35           H        LEU  35   3.339   5.324  -2.992
  266    HA   LEU  35           HA       LEU  35   4.026   2.736  -3.771
  267    HB2  LEU  35           HB3      LEU  35   2.124   3.287  -2.287
  268    HB3  LEU  35           HB2      LEU  35   1.279   3.894  -3.707
  269    HG   LEU  35           HG       LEU  35   1.175   1.670  -4.662
  270   HD11  LEU  35          HD11      LEU  35   2.354  -0.033  -3.886
  271   HD12  LEU  35          HD12      LEU  35   2.215   0.354  -2.235
  272   HD13  LEU  35          HD13      LEU  35   3.410   1.135  -3.310
  273   HD21  LEU  35          HD21      LEU  35   0.269   2.026  -1.882
  274   HD22  LEU  35          HD22      LEU  35   0.005   0.501  -2.721
  275   HD23  LEU  35          HD23      LEU  35  -0.608   2.047  -3.352
  276    H    PHE  36           H        PHE  36   2.211   5.209  -5.531
  277    HA   PHE  36           HA       PHE  36   2.588   3.619  -7.965
  278    HB2  PHE  36           HB3      PHE  36   0.785   5.924  -7.885
  279    HB3  PHE  36           HB2      PHE  36   0.623   4.418  -8.737
  280    HD1  PHE  36           HD1      PHE  36  -0.405   2.588  -7.696
  281    HD2  PHE  36           HD2      PHE  36   0.131   6.095  -5.556
  282    HE1  PHE  36           HE1      PHE  36  -1.912   1.722  -6.008
  283    HE2  PHE  36           HE2      PHE  36  -1.397   5.291  -3.808
  284    HZ   PHE  36           HZ       PHE  36  -2.413   3.054  -4.019
  285    H    GLY  37           H        GLY  37   4.331   5.716  -6.483
  286    HA2  GLY  37           HA3      GLY  37   4.818   7.369  -8.882
  287    HA3  GLY  37           HA2      GLY  37   4.977   8.006  -7.243
  288    H    ARG  38           H        ARG  38   6.255   5.783  -6.087
  289    HA   ARG  38           HA       ARG  38   8.956   6.252  -7.071
  290    HB2  ARG  38           HB3      ARG  38   7.891   4.845  -4.581
  291    HB3  ARG  38           HB2      ARG  38   9.578   4.988  -5.000
  292    HG2  ARG  38           HG3      ARG  38   9.243   7.472  -5.053
  293    HG3  ARG  38           HG2      ARG  38   7.703   7.211  -4.275
  294    HD2  ARG  38           HD3      ARG  38   8.690   6.929  -2.289
  295    HD3  ARG  38           HD2      ARG  38   9.805   5.696  -2.939
  296    HE   ARG  38           HE       ARG  38  11.422   7.323  -2.705
  297   HH11  ARG  38          HH11      ARG  38   8.461   8.900  -3.749
  298   HH12  ARG  38          HH12      ARG  38   9.184  10.450  -3.839
  299   HH21  ARG  38          HH21      ARG  38  12.391   9.383  -2.865
  300   HH22  ARG  38          HH22      ARG  38  11.402  10.730  -3.340
  301    H    LYS  39           H        LYS  39  10.462   4.289  -7.025
  302    HA   LYS  39           HA       LYS  39   9.691   2.476  -9.006
  303    HB2  LYS  39           HB3      LYS  39  12.039   2.939  -8.419
  304    HB3  LYS  39           HB2      LYS  39  11.841   2.101  -6.925
  305    HG2  LYS  39           HG3      LYS  39  12.767   1.020  -9.263
  306    HG3  LYS  39           HG2      LYS  39  12.085   0.160  -7.870
  307    HD2  LYS  39           HD3      LYS  39  11.133  -0.487 -10.009
  308    HD3  LYS  39           HD2      LYS  39   9.896   0.264  -8.999
  309    HE2  LYS  39           HE3      LYS  39  10.458   2.376 -10.201
  310    HE3  LYS  39           HE2      LYS  39  11.241   1.409 -11.374
  311    HZ1  LYS  39           HZ1      LYS  39   9.293   0.610 -12.098
  312    HZ2  LYS  39           HZ2      LYS  39   8.710   2.097 -11.571
  313    HZ3  LYS  39           HZ3      LYS  39   8.515   0.711 -10.623
  314    H    THR  40           H        THR  40  10.788   0.884  -6.168
  315    HA   THR  40           HA       THR  40   8.239  -0.007  -5.330
  316    HB   THR  40           HB       THR  40   8.744  -2.338  -5.043
  317    HG1  THR  40           HG1      THR  40  10.224  -3.533  -5.947
  318   HG21  THR  40          HG21      THR  40   8.422  -2.096  -7.794
  319   HG22  THR  40          HG22      THR  40   8.708  -2.933  -6.583
  320   HG23  THR  40          HG23      THR  40   7.317  -2.951  -6.280
  321    H    GLY  41           H        GLY  41   8.162   0.428  -3.551
  322    HA2  GLY  41           HA3      GLY  41   8.669   0.474  -1.312
  323    HA3  GLY  41           HA2      GLY  41   9.319  -1.171  -1.563
  324    H    GLN  42           H        GLN  42  10.537   1.887  -2.975
  325    HA   GLN  42           HA       GLN  42  13.125   1.320  -1.638
  326    HB2  GLN  42           HB3      GLN  42  13.605   3.341  -3.422
  327    HB3  GLN  42           HB2      GLN  42  13.860   1.668  -3.756
  328    HG2  GLN  42           HG3      GLN  42  12.605   2.792  -5.520
  329    HG3  GLN  42           HG2      GLN  42  11.680   1.461  -4.800
  330   HE21  GLN  42          HE21      GLN  42   9.616   1.969  -4.800
  331   HE22  GLN  42          HE22      GLN  42   8.967   3.472  -4.302
  332    H    ALA  43           H        ALA  43  11.204   2.370   0.016
  333    HA   ALA  43           HA       ALA  43  11.003   5.126   0.205
  334    HB1  ALA  43           HB1      ALA  43  11.098   4.307   2.836
  335    HB2  ALA  43           HB2      ALA  43  10.596   2.887   1.985
  336    HB3  ALA  43           HB3      ALA  43   9.657   4.397   1.843
  337    HA   PRO  44           HA       PRO  44  14.866   6.662   1.726
  338    HB2  PRO  44           HB3      PRO  44  14.248   8.317   3.707
  339    HB3  PRO  44           HB2      PRO  44  13.702   8.627   2.063
  340    HG2  PRO  44           HG3      PRO  44  12.174   7.519   4.343
  341    HG3  PRO  44           HG2      PRO  44  11.641   8.685   3.149
  342    HD2  PRO  44           HD3      PRO  44  11.005   6.058   3.007
  343    HD3  PRO  44           HD2      PRO  44  11.109   7.120   1.622
  344    H    GLY  45           H        GLY  45  14.009   7.261   4.936
  345    HA2  GLY  45           HA3      GLY  45  16.042   5.541   5.948
  346    HA3  GLY  45           HA2      GLY  45  14.917   6.512   6.919
  347    H    PHE  46           H        PHE  46  13.154   4.621   4.668
  348    HA   PHE  46           HA       PHE  46  12.283   2.846   6.803
  349    HB2  PHE  46           HB3      PHE  46  10.631   3.845   5.215
  350    HB3  PHE  46           HB2      PHE  46  11.418   3.045   3.880
  351    HD1  PHE  46           HD1      PHE  46   9.635   2.356   7.059
  352    HD2  PHE  46           HD2      PHE  46  10.787   0.950   3.204
  353    HE1  PHE  46           HE1      PHE  46   8.187   0.380   7.364
  354    HE2  PHE  46           HE2      PHE  46   9.368  -1.052   3.493
  355    HZ   PHE  46           HZ       PHE  46   8.038  -1.327   5.593
  356    H    THR  47           H        THR  47  12.691   0.714   6.976
  357    HA   THR  47           HA       THR  47  14.854  -0.345   5.451
  358    HB   THR  47           HB       THR  47  13.951  -0.709   8.033
  359    HG1  THR  47           HG1      THR  47  15.642  -2.267   8.145
  360   HG21  THR  47          HG21      THR  47  13.644  -3.225   8.188
  361   HG22  THR  47          HG22      THR  47  13.338  -3.167   6.438
  362   HG23  THR  47          HG23      THR  47  12.289  -2.287   7.508
  363    H    TYR  48           H        TYR  48  14.326  -0.920   3.415
  364    HA   TYR  48           HA       TYR  48  11.818  -2.057   2.741
  365    HB2  TYR  48           HB3      TYR  48  13.761  -2.596   0.774
  366    HB3  TYR  48           HB2      TYR  48  12.486  -1.406   0.778
  367    HD1  TYR  48           HD1      TYR  48  15.917  -1.902   2.030
  368    HD2  TYR  48           HD2      TYR  48  13.067   0.833   0.607
  369    HE1  TYR  48           HE1      TYR  48  17.616  -0.196   2.153
  370    HE2  TYR  48           HE2      TYR  48  14.810   2.592   0.685
  371    HH   TYR  48           HH       TYR  48  17.887   2.109   2.144
  372    H    THR  49           H        THR  49  11.591  -4.117   1.716
  373    HA   THR  49           HA       THR  49  12.868  -6.265   3.199
  374    HB   THR  49           HB       THR  49  11.264  -7.700   2.110
  375    HG1  THR  49           HG1      THR  49   9.815  -6.656   0.515
  376   HG21  THR  49          HG21      THR  49   9.353  -5.567   2.246
  377   HG22  THR  49          HG22      THR  49  10.491  -5.579   3.643
  378   HG23  THR  49          HG23      THR  49   9.519  -7.004   3.254
  379    H    ASP  50           H        ASP  50  13.526  -8.296   1.815
  380    HA   ASP  50           HA       ASP  50  15.825  -7.613   0.337
  381    HB2  ASP  50           HB3      ASP  50  15.866  -9.813   1.029
  382    HB3  ASP  50           HB2      ASP  50  14.171 -10.080   0.630
  383    H    ALA  51           H        ALA  51  12.456  -8.083  -0.749
  384    HA   ALA  51           HA       ALA  51  13.011  -8.059  -3.475
  385    HB1  ALA  51           HB1      ALA  51  10.913  -8.729  -3.585
  386    HB2  ALA  51           HB2      ALA  51  10.364  -7.135  -2.944
  387    HB3  ALA  51           HB3      ALA  51  10.749  -8.449  -1.832
  388    H    ASN  52           H        ASN  52  11.919  -5.589  -1.215
  389    HA   ASN  52           HA       ASN  52  11.624  -3.513  -3.066
  390    HB2  ASN  52           HB3      ASN  52  12.336  -3.365  -0.122
  391    HB3  ASN  52           HB2      ASN  52  11.835  -2.001  -1.096
  392   HD21  ASN  52          HD21      ASN  52  10.042  -4.101  -2.523
  393   HD22  ASN  52          HD22      ASN  52   8.643  -4.150  -1.510
  394    H    LYS  53           H        LYS  53  14.427  -4.510  -1.115
  395    HA   LYS  53           HA       LYS  53  16.128  -2.414  -1.893
  396    HB2  LYS  53           HB3      LYS  53  17.957  -4.073  -1.348
  397    HB3  LYS  53           HB2      LYS  53  16.785  -3.822  -0.061
  398    HG2  LYS  53           HG3      LYS  53  15.662  -5.840  -0.485
  399    HG3  LYS  53           HG2      LYS  53  16.631  -6.115  -1.914
  400    HD2  LYS  53           HD3      LYS  53  17.753  -7.456  -0.485
  401    HD3  LYS  53           HD2      LYS  53  18.664  -5.915  -0.261
  402    HE2  LYS  53           HE3      LYS  53  18.130  -5.977   1.886
  403    HE3  LYS  53           HE2      LYS  53  16.447  -5.894   1.483
  404    HZ1  LYS  53           HZ1      LYS  53  17.939  -8.089   2.431
  405    HZ2  LYS  53           HZ2      LYS  53  17.118  -8.469   1.041
  406    HZ3  LYS  53           HZ3      LYS  53  16.262  -7.876   2.374
  407    H    ASN  54           H        ASN  54  15.181  -5.335  -3.465
  408    HA   ASN  54           HA       ASN  54  17.177  -5.242  -5.533
  409    HB2  ASN  54           HB3      ASN  54  14.548  -6.742  -5.479
  410    HB3  ASN  54           HB2      ASN  54  15.855  -6.991  -6.591
  411   HD21  ASN  54          HD21      ASN  54  17.264  -6.216  -3.706
  412   HD22  ASN  54          HD22      ASN  54  17.540  -7.788  -3.109
  413    H    LYS  55           H        LYS  55  14.284  -3.606  -4.935
  414    HA   LYS  55           HA       LYS  55  13.210  -1.934  -6.048
  415    HB2  LYS  55           HB3      LYS  55  15.496  -2.410  -7.949
  416    HB3  LYS  55           HB2      LYS  55  14.248  -1.273  -8.343
  417    HG2  LYS  55           HG3      LYS  55  15.063   0.218  -6.938
  418    HG3  LYS  55           HG2      LYS  55  15.380  -0.967  -5.657
  419    HD2  LYS  55           HD3      LYS  55  17.096  -0.191  -8.054
  420    HD3  LYS  55           HD2      LYS  55  17.506  -0.124  -6.338
  421    HE2  LYS  55           HE3      LYS  55  17.129  -2.667  -6.402
  422    HE3  LYS  55           HE2      LYS  55  17.377  -2.460  -8.144
  423    HZ1  LYS  55           HZ1      LYS  55  19.503  -2.884  -7.268
  424    HZ2  LYS  55           HZ2      LYS  55  19.223  -1.959  -5.892
  425    HZ3  LYS  55           HZ3      LYS  55  19.469  -1.232  -7.400
  426    H    GLY  56           H        GLY  56  11.784  -4.010  -6.106
  427    HA2  GLY  56           HA3      GLY  56  11.377  -5.543  -8.425
  428    HA3  GLY  56           HA2      GLY  56  10.107  -5.089  -7.249
  429    H    ILE  57           H        ILE  57   8.493  -3.706  -7.822
  430    HA   ILE  57           HA       ILE  57   8.987  -1.926 -10.014
  431    HB   ILE  57           HB       ILE  57   7.844  -4.359 -10.624
  432   HG12  ILE  57          HG13      ILE  57   8.708  -3.215 -12.387
  433   HG13  ILE  57          HG12      ILE  57   6.973  -2.870 -12.667
  434   HG21  ILE  57          HG21      ILE  57   5.742  -3.971  -9.590
  435   HG22  ILE  57          HG22      ILE  57   5.468  -3.655 -11.282
  436   HG23  ILE  57          HG23      ILE  57   5.695  -2.316 -10.113
  437   HD11  ILE  57          HD11      ILE  57   7.187  -0.726 -12.130
  438   HD12  ILE  57          HD12      ILE  57   8.882  -0.996 -12.665
  439   HD13  ILE  57          HD13      ILE  57   8.449  -1.015 -10.959
  440    H    THR  58           H        THR  58   6.989  -0.569 -10.497
  441    HA   THR  58           HA       THR  58   6.096   0.524  -7.984
  442    HB   THR  58           HB       THR  58   6.521   1.533 -10.534
  443    HG1  THR  58           HG1      THR  58   6.030   3.473  -9.510
  444   HG21  THR  58          HG21      THR  58   4.162   0.993 -11.049
  445   HG22  THR  58          HG22      THR  58   4.519   2.692 -11.114
  446   HG23  THR  58          HG23      THR  58   3.707   2.004  -9.726
  447    H    TRP  59           H        TRP  59   4.444  -0.216  -6.930
  448    HA   TRP  59           HA       TRP  59   2.517  -1.957  -8.004
  449    HB2  TRP  59           HB3      TRP  59   1.856  -0.531  -5.498
  450    HB3  TRP  59           HB2      TRP  59   1.821  -2.239  -5.878
  451    HD1  TRP  59           HD1      TRP  59   4.259   0.526  -4.934
  452    HE1  TRP  59           HE1      TRP  59   6.325  -0.501  -3.768
  453    HE3  TRP  59           HE3      TRP  59   3.112  -4.350  -5.613
  454    HZ2  TRP  59           HZ2      TRP  59   7.325  -3.087  -3.252
  455    HZ3  TRP  59           HZ3      TRP  59   4.704  -6.066  -4.778
  456    HH2  TRP  59           HH2      TRP  59   6.736  -5.446  -3.609
  457    H    LYS  60           H        LYS  60   1.085  -1.340  -9.511
  458    HA   LYS  60           HA       LYS  60  -0.170   1.321  -9.268
  459    HB2  LYS  60           HB3      LYS  60   0.148   1.463 -11.432
  460    HB3  LYS  60           HB2      LYS  60   0.812  -0.197 -11.460
  461    HG2  LYS  60           HG3      LYS  60  -0.957  -0.529 -12.832
  462    HG3  LYS  60           HG2      LYS  60  -1.901  -0.668 -11.370
  463    HD2  LYS  60           HD3      LYS  60  -2.992   1.219 -11.728
  464    HD3  LYS  60           HD2      LYS  60  -1.541   2.063 -12.274
  465    HE2  LYS  60           HE3      LYS  60  -2.206   0.119 -14.227
  466    HE3  LYS  60           HE2      LYS  60  -3.671   1.039 -13.838
  467    HZ1  LYS  60           HZ1      LYS  60  -1.760   1.857 -15.541
  468    HZ2  LYS  60           HZ2      LYS  60  -1.388   2.746 -14.171
  469    HZ3  LYS  60           HZ3      LYS  60  -2.958   2.866 -14.857
  470    H    GLU  61           H        GLU  61  -2.496   1.374 -10.053
  471    HA   GLU  61           HA       GLU  61  -4.092  -0.099  -8.299
  472    HB2  GLU  61           HB3      GLU  61  -4.494   2.059  -9.949
  473    HB3  GLU  61           HB2      GLU  61  -5.532   0.793 -10.627
  474    HG2  GLU  61           HG3      GLU  61  -5.800   0.839  -7.779
  475    HG3  GLU  61           HG2      GLU  61  -5.954   2.500  -8.412
  476    H    GLU  62           H        GLU  62  -3.905  -0.408 -11.841
  477    HA   GLU  62           HA       GLU  62  -5.458  -2.715 -12.060
  478    HB2  GLU  62           HB3      GLU  62  -5.011  -2.662 -14.270
  479    HB3  GLU  62           HB2      GLU  62  -4.617  -1.004 -13.839
  480    HG2  GLU  62           HG3      GLU  62  -2.230  -1.623 -13.642
  481    HG3  GLU  62           HG2      GLU  62  -2.641  -3.242 -14.206
  482    H    THR  63           H        THR  63  -1.914  -2.312 -11.788
  483    HA   THR  63           HA       THR  63  -1.267  -4.992 -12.121
  484    HB   THR  63           HB       THR  63   0.112  -2.561 -11.689
  485    HG1  THR  63           HG1      THR  63   1.423  -3.636 -12.884
  486   HG21  THR  63          HG21      THR  63   1.584  -2.909  -9.978
  487   HG22  THR  63          HG22      THR  63   1.325  -4.625  -9.879
  488   HG23  THR  63          HG23      THR  63   0.128  -3.523  -9.251
  489    H    LEU  64           H        LEU  64  -2.363  -3.151  -9.421
  490    HA   LEU  64           HA       LEU  64  -1.571  -5.046  -7.378
  491    HB2  LEU  64           HB3      LEU  64  -3.040  -2.531  -7.533
  492    HB3  LEU  64           HB2      LEU  64  -3.728  -3.630  -6.391
  493    HG   LEU  64           HG       LEU  64  -0.884  -2.620  -6.425
  494   HD11  LEU  64          HD11      LEU  64  -1.969  -0.871  -5.475
  495   HD12  LEU  64          HD12      LEU  64  -1.899  -1.877  -4.034
  496   HD13  LEU  64          HD13      LEU  64  -3.356  -1.841  -4.979
  497   HD21  LEU  64          HD21      LEU  64  -0.577  -3.885  -4.361
  498   HD22  LEU  64          HD22      LEU  64  -1.085  -4.972  -5.615
  499   HD23  LEU  64          HD23      LEU  64  -2.269  -4.445  -4.436
  500    H    MET  65           H        MET  65  -4.407  -4.587  -9.403
  501    HA   MET  65           HA       MET  65  -6.194  -6.247  -8.047
  502    HB2  MET  65           HB3      MET  65  -5.978  -5.451 -10.979
  503    HB3  MET  65           HB2      MET  65  -7.258  -6.494 -10.404
  504    HG2  MET  65           HG3      MET  65  -6.668  -3.667  -9.624
  505    HG3  MET  65           HG2      MET  65  -8.082  -4.293 -10.482
  506    HE1  MET  65           HE1      MET  65  -6.591  -3.129  -7.289
  507    HE2  MET  65           HE2      MET  65  -6.132  -4.795  -7.021
  508    HE3  MET  65           HE3      MET  65  -7.335  -4.041  -5.989
  509    H    GLU  66           H        GLU  66  -3.786  -6.921 -10.568
  510    HA   GLU  66           HA       GLU  66  -4.487  -9.739 -10.701
  511    HB2  GLU  66           HB3      GLU  66  -2.274  -9.770 -12.052
  512    HB3  GLU  66           HB2      GLU  66  -3.606  -8.930 -12.718
  513    HG2  GLU  66           HG3      GLU  66  -2.687  -6.777 -12.016
  514    HG3  GLU  66           HG2      GLU  66  -1.392  -7.618 -11.208
  515    H    TYR  67           H        TYR  67  -2.068  -7.695  -9.130
  516    HA   TYR  67           HA       TYR  67  -0.380  -9.712  -8.214
  517    HB2  TYR  67           HB3      TYR  67   0.613  -7.676  -7.929
  518    HB3  TYR  67           HB2      TYR  67  -0.871  -6.883  -7.596
  519    HD1  TYR  67           HD1      TYR  67   2.020  -8.585  -6.246
  520    HD2  TYR  67           HD2      TYR  67  -1.726  -6.978  -5.225
  521    HE1  TYR  67           HE1      TYR  67   2.651  -8.674  -3.849
  522    HE2  TYR  67           HE2      TYR  67  -1.132  -7.042  -2.853
  523    HH   TYR  67           HH       TYR  67   0.659  -7.103  -1.461
  524    H    LEU  68           H        LEU  68  -3.444  -8.713  -7.169
  525    HA   LEU  68           HA       LEU  68  -3.415  -9.545  -4.491
  526    HB2  LEU  68           HB3      LEU  68  -5.606  -9.206  -6.537
  527    HB3  LEU  68           HB2      LEU  68  -5.919  -9.867  -4.946
  528    HG   LEU  68           HG       LEU  68  -4.644  -7.187  -5.390
  529   HD11  LEU  68          HD11      LEU  68  -6.797  -6.199  -5.023
  530   HD12  LEU  68          HD12      LEU  68  -7.530  -7.762  -4.657
  531   HD13  LEU  68          HD13      LEU  68  -6.985  -7.399  -6.302
  532   HD21  LEU  68          HD21      LEU  68  -4.134  -8.147  -3.272
  533   HD22  LEU  68          HD22      LEU  68  -5.475  -7.221  -2.618
  534   HD23  LEU  68          HD23      LEU  68  -5.251  -6.830  -3.071
  535    H    GLU  69           H        GLU  69  -3.316 -11.359  -7.390
  536    HA   GLU  69           HA       GLU  69  -4.608 -13.698  -6.648
  537    HB2  GLU  69           HB3      GLU  69  -3.250 -12.812  -8.869
  538    HB3  GLU  69           HB2      GLU  69  -2.225 -14.115  -8.287
  539    HG2  GLU  69           HG3      GLU  69  -4.054 -15.662  -8.335
  540    HG3  GLU  69           HG2      GLU  69  -5.138 -14.409  -8.900
  541    H    ASN  70           H        ASN  70  -1.121 -13.579  -7.025
  542    HA   ASN  70           HA       ASN  70  -0.935 -15.112  -4.550
  543    HB2  ASN  70           HB3      ASN  70   0.447 -15.437  -7.119
  544    HB3  ASN  70           HB2      ASN  70   1.282 -15.926  -5.684
  545   HD21  ASN  70          HD21      ASN  70  -1.080 -16.763  -7.961
  546   HD22  ASN  70          HD22      ASN  70  -1.595 -18.206  -7.258
  547    HA   PRO  71           HA       PRO  71   1.104 -11.130  -3.550
  548    HB2  PRO  71           HB3      PRO  71   1.117 -12.544  -0.959
  549    HB3  PRO  71           HB2      PRO  71   0.681 -10.904  -1.296
  550    HG2  PRO  71           HG3      PRO  71  -1.212 -12.714  -0.823
  551    HG3  PRO  71           HG2      PRO  71  -1.428 -11.424  -2.075
  552    HD2  PRO  71           HD3      PRO  71  -0.808 -14.349  -2.410
  553    HD3  PRO  71           HD2      PRO  71  -1.789 -13.258  -3.421
  554    H    LYS  72           H        LYS  72   2.043 -14.429  -2.771
  555    HA   LYS  72           HA       LYS  72   4.773 -13.687  -2.171
  556    HB2  LYS  72           HB3      LYS  72   4.773 -15.699  -1.207
  557    HB3  LYS  72           HB2      LYS  72   3.114 -15.956  -1.769
  558    HG2  LYS  72           HG3      LYS  72   4.135 -17.797  -2.619
  559    HG3  LYS  72           HG2      LYS  72   4.323 -16.681  -4.000
  560    HD2  LYS  72           HD3      LYS  72   6.500 -16.382  -2.209
  561    HD3  LYS  72           HD2      LYS  72   6.310 -18.064  -2.599
  562    HE2  LYS  72           HE3      LYS  72   5.962 -16.633  -4.995
  563    HE3  LYS  72           HE2      LYS  72   7.363 -15.957  -4.209
  564    HZ1  LYS  72           HZ1      LYS  72   8.371 -18.141  -4.007
  565    HZ2  LYS  72           HZ2      LYS  72   7.996 -17.785  -5.647
  566    HZ3  LYS  72           HZ3      LYS  72   6.982 -18.822  -4.754
  567    H    LYS  73           H        LYS  73   2.957 -14.557  -4.992
  568    HA   LYS  73           HA       LYS  73   5.105 -15.511  -6.514
  569    HB2  LYS  73           HB3      LYS  73   3.615 -15.607  -8.285
  570    HB3  LYS  73           HB2      LYS  73   2.547 -15.711  -6.861
  571    HG2  LYS  73           HG3      LYS  73   1.386 -14.129  -8.019
  572    HG3  LYS  73           HG2      LYS  73   2.596 -13.052  -7.216
  573    HD2  LYS  73           HD3      LYS  73   2.205 -12.812  -9.778
  574    HD3  LYS  73           HD2      LYS  73   3.876 -12.882  -9.168
  575    HE2  LYS  73           HE3      LYS  73   3.304 -14.268 -11.203
  576    HE3  LYS  73           HE2      LYS  73   4.074 -15.112  -9.892
  577    HZ1  LYS  73           HZ1      LYS  73   1.736 -15.768  -9.220
  578    HZ2  LYS  73           HZ2      LYS  73   2.333 -16.476 -10.620
  579    HZ3  LYS  73           HZ3      LYS  73   1.233 -15.208 -10.701
  580    H    TYR  74           H        TYR  74   3.877 -12.348  -5.763
  581    HA   TYR  74           HA       TYR  74   5.335 -11.018  -7.852
  582    HB2  TYR  74           HB3      TYR  74   3.410 -10.220  -5.751
  583    HB3  TYR  74           HB2      TYR  74   4.631  -8.994  -6.229
  584    HD1  TYR  74           HD1      TYR  74   2.085 -11.318  -7.686
  585    HD2  TYR  74           HD2      TYR  74   4.233  -7.667  -8.075
  586    HE1  TYR  74           HE1      TYR  74   0.760 -10.759  -9.696
  587    HE2  TYR  74           HE2      TYR  74   2.918  -7.071 -10.073
  588    HH   TYR  74           HH       TYR  74   0.666  -9.341 -11.505
  589    H    ILE  75           H        ILE  75   5.610 -11.365  -4.326
  590    HA   ILE  75           HA       ILE  75   8.408 -10.574  -4.563
  591    HB   ILE  75           HB       ILE  75   6.405  -9.601  -2.580
  592   HG12  ILE  75          HG13      ILE  75   6.460  -8.089  -4.291
  593   HG13  ILE  75          HG12      ILE  75   7.648  -7.399  -3.204
  594   HG21  ILE  75          HG21      ILE  75   8.434  -8.509  -1.471
  595   HG22  ILE  75          HG22      ILE  75   9.404  -9.679  -2.407
  596   HG23  ILE  75          HG23      ILE  75   8.263 -10.262  -1.198
  597   HD11  ILE  75          HD11      ILE  75   8.948  -7.316  -4.986
  598   HD12  ILE  75          HD12      ILE  75   7.991  -8.530  -5.901
  599   HD13  ILE  75          HD13      ILE  75   9.204  -9.035  -4.687
  600    HA   PRO  76           HA       PRO  76   7.922 -14.754  -2.577
  601    HB2  PRO  76           HB3      PRO  76  10.614 -14.999  -3.806
  602    HB3  PRO  76           HB2      PRO  76   9.299 -16.102  -3.869
  603    HG2  PRO  76           HG3      PRO  76   9.945 -14.676  -5.958
  604    HG3  PRO  76           HG2      PRO  76   8.253 -15.001  -5.586
  605    HD2  PRO  76           HD3      PRO  76   9.804 -12.504  -5.153
  606    HD3  PRO  76           HD2      PRO  76   8.143 -12.693  -5.680
  607    H    GLY  77           H        GLY  77   8.581 -15.151  -0.580
  608    HA2  GLY  77           HA3      GLY  77  10.360 -15.403   1.073
  609    HA3  GLY  77           HA2      GLY  77  11.099 -13.973   0.334
  610    H    THR  78           H        THR  78   8.235 -12.780   0.235
  611    HA   THR  78           HA       THR  78   8.342 -11.707   2.984
  612    HB   THR  78           HB       THR  78   8.185 -10.448   0.551
  613    HG1  THR  78           HG1      THR  78   7.185  -9.403   2.982
  614   HG21  THR  78          HG21      THR  78   5.706 -11.246   0.488
  615   HG22  THR  78          HG22      THR  78   6.042  -9.527   0.220
  616   HG23  THR  78          HG23      THR  78   5.491 -10.046   1.805
  617    H    LYS  79           H        LYS  79   6.830 -12.189   4.397
  618    HA   LYS  79           HA       LYS  79   4.454 -13.581   3.516
  619    HB2  LYS  79           HB3      LYS  79   6.153 -14.579   5.201
  620    HB3  LYS  79           HB2      LYS  79   5.350 -13.557   6.351
  621    HG2  LYS  79           HG3      LYS  79   4.570 -15.997   6.119
  622    HG3  LYS  79           HG2      LYS  79   3.369 -14.738   6.286
  623    HD2  LYS  79           HD3      LYS  79   2.832 -16.332   4.474
  624    HD3  LYS  79           HD2      LYS  79   2.971 -14.666   3.904
  625    HE2  LYS  79           HE3      LYS  79   4.095 -16.356   2.405
  626    HE3  LYS  79           HE2      LYS  79   5.195 -15.091   3.030
  627    HZ1  LYS  79           HZ1      LYS  79   6.072 -17.394   3.086
  628    HZ2  LYS  79           HZ2      LYS  79   4.884 -17.813   4.216
  629    HZ3  LYS  79           HZ3      LYS  79   6.042 -16.654   4.622
  630    H    MET  80           H        MET  80   2.517 -12.998   4.117
  631    HA   MET  80           HA       MET  80   2.376 -10.341   5.400
  632    HB2  MET  80           HB3      MET  80   0.646 -11.772   3.354
  633    HB3  MET  80           HB2      MET  80  -0.086 -10.535   4.369
  634    HG2  MET  80           HG3      MET  80   2.428  -9.993   2.868
  635    HG3  MET  80           HG2      MET  80   0.840  -9.819   2.100
  636    HE1  MET  80           HE1      MET  80  -0.456  -8.258   2.059
  637    HE2  MET  80           HE2      MET  80   0.133  -6.601   2.312
  638    HE3  MET  80           HE3      MET  80  -1.004  -7.372   3.482
  639    H    ILE  81           H        ILE  81   1.958 -10.314   7.298
  640    HA   ILE  81           HA       ILE  81   0.286 -12.352   8.630
  641    HB   ILE  81           HB       ILE  81   2.398 -10.554   9.810
  642   HG12  ILE  81          HG13      ILE  81   3.285 -13.010  10.318
  643   HG13  ILE  81          HG12      ILE  81   2.377 -13.342   8.870
  644   HG21  ILE  81          HG21      ILE  81   1.379 -12.798  11.394
  645   HG22  ILE  81          HG22      ILE  81   0.224 -11.466  11.119
  646   HG23  ILE  81          HG23      ILE  81   1.770 -11.156  11.872
  647   HD11  ILE  81          HD11      ILE  81   4.427 -12.888   7.953
  648   HD12  ILE  81          HD12      ILE  81   4.833 -11.687   9.249
  649   HD13  ILE  81          HD13      ILE  81   3.686 -11.263   7.901
  650    H    PHE  82           H        PHE  82  -1.511 -11.884   9.603
  651    HA   PHE  82           HA       PHE  82  -3.022 -10.597  10.726
  652    HB2  PHE  82           HB3      PHE  82  -1.011  -9.133  11.278
  653    HB3  PHE  82           HB2      PHE  82  -1.584  -8.073  10.033
  654    HD1  PHE  82           HD1      PHE  82  -2.182  -9.470  13.386
  655    HD2  PHE  82           HD2      PHE  82  -3.557  -6.852  10.353
  656    HE1  PHE  82           HE1      PHE  82  -3.702  -8.448  14.976
  657    HE2  PHE  82           HE2      PHE  82  -5.121  -5.881  11.906
  658    HZ   PHE  82           HZ       PHE  82  -5.253  -6.660  14.240
  659    H    ALA  83           H        ALA  83  -4.658  -8.956  10.114
  660    HA   ALA  83           HA       ALA  83  -5.197  -7.548   8.020
  661    HB1  ALA  83           HB1      ALA  83  -5.907  -9.294   6.239
  662    HB2  ALA  83           HB2      ALA  83  -4.616 -10.213   6.972
  663    HB3  ALA  83           HB3      ALA  83  -4.271  -8.639   6.313
  664    H    GLY  84           H        GLY  84  -6.924  -7.093   9.505
  665    HA2  GLY  84           HA3      GLY  84  -8.910  -9.096  10.011
  666    HA3  GLY  84           HA2      GLY  84  -8.979  -7.398  10.499
  667    H    ILE  85           H        ILE  85  -8.356  -7.898   7.244
  668    HA   ILE  85           HA       ILE  85 -11.216  -7.533   6.509
  669    HB   ILE  85           HB       ILE  85  -8.895  -5.904   5.421
  670   HG12  ILE  85          HG13      ILE  85 -10.464  -5.519   7.736
  671   HG13  ILE  85          HG12      ILE  85  -9.468  -4.343   6.908
  672   HG21  ILE  85          HG21      ILE  85 -11.817  -5.851   4.681
  673   HG22  ILE  85          HG22      ILE  85 -10.539  -6.481   3.681
  674   HG23  ILE  85          HG23      ILE  85 -10.575  -4.792   4.053
  675   HD11  ILE  85          HD11      ILE  85 -11.585  -3.989   5.422
  676   HD12  ILE  85          HD12      ILE  85 -11.502  -3.286   7.012
  677   HD13  ILE  85          HD13      ILE  85 -12.403  -4.783   6.772
  678    H    LYS  86           H        LYS  86 -11.839  -8.355   4.484
  679    HA   LYS  86           HA       LYS  86  -9.844  -9.562   2.781
  680    HB2  LYS  86           HB3      LYS  86 -11.421 -11.679   2.831
  681    HB3  LYS  86           HB2      LYS  86 -10.084 -11.541   3.942
  682    HG2  LYS  86           HG3      LYS  86 -12.357 -10.245   5.108
  683    HG3  LYS  86           HG2      LYS  86 -12.855 -11.834   4.527
  684    HD2  LYS  86           HD3      LYS  86 -11.359 -12.907   5.955
  685    HD3  LYS  86           HD2      LYS  86 -10.291 -11.508   6.071
  686    HE2  LYS  86           HE3      LYS  86 -12.406 -10.452   7.218
  687    HE3  LYS  86           HE2      LYS  86 -12.829 -12.094   7.519
  688    HZ1  LYS  86           HZ1      LYS  86 -10.184 -11.043   8.211
  689    HZ2  LYS  86           HZ2      LYS  86 -10.980 -12.404   8.826
  690    HZ3  LYS  86           HZ3      LYS  86 -11.495 -10.852   9.266
  691    H    LYS  87           H        LYS  87 -13.235  -8.897   3.452
  692    HA   LYS  87           HA       LYS  87 -14.546  -9.527   1.230
  693    HB2  LYS  87           HB3      LYS  87 -14.868  -7.667   3.302
  694    HB3  LYS  87           HB2      LYS  87 -15.060  -6.745   1.816
  695    HG2  LYS  87           HG3      LYS  87 -17.172  -7.437   1.711
  696    HG3  LYS  87           HG2      LYS  87 -16.550  -9.060   1.441
  697    HD2  LYS  87           HD3      LYS  87 -16.390  -9.249   3.987
  698    HD3  LYS  87           HD2      LYS  87 -17.317  -7.738   4.021
  699    HE2  LYS  87           HE3      LYS  87 -18.639  -9.862   4.278
  700    HE3  LYS  87           HE2      LYS  87 -19.145  -8.806   2.924
  701    HZ1  LYS  87           HZ1      LYS  87 -18.856 -11.331   2.531
  702    HZ2  LYS  87           HZ2      LYS  87 -17.238 -10.955   2.417
  703    HZ3  LYS  87           HZ3      LYS  87 -18.342 -10.237   1.356
  704    H    LYS  88           H        LYS  88 -14.096  -9.339  -0.844
  705    HA   LYS  88           HA       LYS  88 -12.021  -7.911  -1.989
  706    HB2  LYS  88           HB3      LYS  88 -13.203  -9.685  -3.190
  707    HB3  LYS  88           HB2      LYS  88 -14.639  -8.721  -3.276
  708    HG2  LYS  88           HG3      LYS  88 -13.677  -7.196  -4.801
  709    HG3  LYS  88           HG2      LYS  88 -12.044  -7.903  -4.581
  710    HD2  LYS  88           HD3      LYS  88 -14.279  -8.807  -6.273
  711    HD3  LYS  88           HD2      LYS  88 -12.516  -9.042  -6.453
  712    HE2  LYS  88           HE3      LYS  88 -13.499 -11.191  -6.131
  713    HE3  LYS  88           HE2      LYS  88 -12.564 -10.738  -4.644
  714    HZ1  LYS  88           HZ1      LYS  88 -15.209 -11.570  -4.802
  715    HZ2  LYS  88           HZ2      LYS  88 -15.261  -9.919  -4.420
  716    HZ3  LYS  88           HZ3      LYS  88 -14.389 -10.929  -3.430
  717    H    THR  89           H        THR  89 -15.343  -6.903  -1.412
  718    HA   THR  89           HA       THR  89 -15.183  -4.449  -2.878
  719    HB   THR  89           HB       THR  89 -17.323  -4.036  -2.082
  720    HG1  THR  89           HG1      THR  89 -17.213  -3.823   0.015
  721   HG21  THR  89          HG21      THR  89 -17.199  -6.988  -1.515
  722   HG22  THR  89          HG22      THR  89 -17.249  -6.308  -3.108
  723   HG23  THR  89          HG23      THR  89 -18.621  -6.017  -2.028
  724    H    GLU  90           H        GLU  90 -14.309  -5.383   0.355
  725    HA   GLU  90           HA       GLU  90 -14.049  -2.721   1.373
  726    HB2  GLU  90           HB3      GLU  90 -12.794  -5.247   2.419
  727    HB3  GLU  90           HB2      GLU  90 -12.997  -3.749   3.316
  728    HG2  GLU  90           HG3      GLU  90 -15.492  -4.926   2.176
  729    HG3  GLU  90           HG2      GLU  90 -14.716  -5.874   3.479
  730    H    ARG  91           H        ARG  91 -11.823  -5.184   0.240
  731    HA   ARG  91           HA       ARG  91  -9.468  -3.699   0.624
  732    HB2  ARG  91           HB3      ARG  91  -9.986  -5.922  -1.293
  733    HB3  ARG  91           HB2      ARG  91  -8.446  -5.081  -1.173
  734    HG2  ARG  91           HG3      ARG  91  -8.877  -5.692   1.421
  735    HG3  ARG  91           HG2      ARG  91  -9.672  -7.062   0.620
  736    HD2  ARG  91           HD3      ARG  91  -7.034  -6.869  -0.671
  737    HD3  ARG  91           HD2      ARG  91  -6.926  -6.590   1.071
  738    HE   ARG  91           HE       ARG  91  -8.247  -8.713   1.111
  739   HH11  ARG  91          HH11      ARG  91  -5.867  -7.774  -1.251
  740   HH12  ARG  91          HH12      ARG  91  -5.328  -9.324  -1.523
  741   HH21  ARG  91          HH21      ARG  91  -7.563 -10.854   0.716
  742   HH22  ARG  91          HH22      ARG  91  -6.307 -11.156  -0.422
  743    H    GLU  92           H        GLU  92 -11.418  -4.116  -2.216
  744    HA   GLU  92           HA       GLU  92  -9.941  -2.457  -3.910
  745    HB2  GLU  92           HB3      GLU  92 -11.817  -4.037  -4.586
  746    HB3  GLU  92           HB2      GLU  92 -12.934  -2.832  -4.020
  747    HG2  GLU  92           HG3      GLU  92 -12.690  -2.703  -6.400
  748    HG3  GLU  92           HG2      GLU  92 -11.986  -1.263  -5.664
  749    H    ASP  93           H        ASP  93 -12.611  -1.730  -1.724
  750    HA   ASP  93           HA       ASP  93 -13.070   0.924  -2.473
  751    HB2  ASP  93           HB3      ASP  93 -14.634  -0.065  -0.995
  752    HB3  ASP  93           HB2      ASP  93 -13.379  -0.524   0.151
  753    H    GLY  94           H        GLY  94 -10.766  -0.369  -0.089
  754    HA2  GLY  94           HA3      GLY  94  -9.732   1.963   0.804
  755    HA3  GLY  94           HA2      GLY  94  -8.895   0.422   0.832
  756    H    ILE  95           H        ILE  95  -8.900   0.060  -1.878
  757    HA   ILE  95           HA       ILE  95  -6.534   1.286  -2.587
  758    HB   ILE  95           HB       ILE  95  -8.474  -0.384  -4.010
  759   HG12  ILE  95          HG13      ILE  95  -5.474  -0.346  -3.630
  760   HG13  ILE  95          HG12      ILE  95  -6.631  -1.395  -2.863
  761   HG21  ILE  95          HG21      ILE  95  -8.363   0.670  -5.936
  762   HG22  ILE  95          HG22      ILE  95  -6.673   0.183  -5.971
  763   HG23  ILE  95          HG23      ILE  95  -7.062   1.766  -5.331
  764   HD11  ILE  95          HD11      ILE  95  -6.304  -1.389  -5.809
  765   HD12  ILE  95          HD12      ILE  95  -7.015  -2.630  -4.776
  766   HD13  ILE  95          HD13      ILE  95  -5.271  -2.345  -4.780
  767    H    ALA  96           H        ALA  96  -9.859   2.114  -3.338
  768    HA   ALA  96           HA       ALA  96  -9.453   4.020  -5.290
  769    HB1  ALA  96           HB1      ALA  96 -11.658   3.268  -4.852
  770    HB2  ALA  96           HB2      ALA  96 -11.629   4.934  -4.601
  771    HB3  ALA  96           HB3      ALA  96 -11.652   3.820  -3.229
  772    H    TYR  97           H        TYR  97  -9.716   4.278  -1.747
  773    HA   TYR  97           HA       TYR  97  -9.275   7.016  -1.550
  774    HB2  TYR  97           HB3      TYR  97 -10.123   5.924   0.387
  775    HB3  TYR  97           HB2      TYR  97  -8.775   4.742   0.330
  776    HD1  TYR  97           HD1      TYR  97  -7.825   5.076   2.448
  777    HD2  TYR  97           HD2      TYR  97  -8.569   8.442   0.002
  778    HE1  TYR  97           HE1      TYR  97  -6.574   6.466   3.985
  779    HE2  TYR  97           HE2      TYR  97  -7.283   9.877   1.586
  780    HH   TYR  97           HH       TYR  97  -5.482   8.475   4.250
  781    H    LEU  98           H        LEU  98  -7.074   4.314  -1.730
  782    HA   LEU  98           HA       LEU  98  -4.670   5.672  -1.176
  783    HB2  LEU  98           HB3      LEU  98  -5.445   3.050  -1.846
  784    HB3  LEU  98           HB2      LEU  98  -4.381   3.557  -3.142
  785    HG   LEU  98           HG       LEU  98  -3.635   3.747  -0.211
  786   HD11  LEU  98          HD11      LEU  98  -2.159   1.719  -1.339
  787   HD12  LEU  98          HD12      LEU  98  -3.771   1.444  -1.999
  788   HD13  LEU  98          HD13      LEU  98  -3.551   1.489  -0.248
  789   HD21  LEU  98          HD21      LEU  98  -2.108   3.939  -2.821
  790   HD22  LEU  98          HD22      LEU  98  -1.343   3.738  -1.288
  791   HD23  LEU  98          HD23      LEU  98  -2.290   5.160  -1.561
  792    H    LYS  99           H        LYS  99  -6.525   5.260  -4.114
  793    HA   LYS  99           HA       LYS  99  -4.607   6.155  -5.976
  794    HB2  LYS  99           HB3      LYS  99  -7.589   6.764  -6.148
  795    HB3  LYS  99           HB2      LYS  99  -6.462   6.514  -7.464
  796    HG2  LYS  99           HG3      LYS  99  -7.380   4.367  -5.573
  797    HG3  LYS  99           HG2      LYS  99  -7.826   4.585  -7.255
  798    HD2  LYS  99           HD3      LYS  99  -6.132   2.877  -6.583
  799    HD3  LYS  99           HD2      LYS  99  -5.235   4.458  -7.597
  800    HE2  LYS  99           HE3      LYS  99  -4.009   3.732  -5.900
  801    HE3  LYS  99           HE2      LYS  99  -5.441   3.906  -4.877
  802    HZ1  LYS  99           HZ1      LYS  99  -4.119   1.647  -5.586
  803    HZ2  LYS  99           HZ2      LYS  99  -5.611   1.556  -6.321
  804    HZ3  LYS  99           HZ3      LYS  99  -5.498   1.780  -4.659
  805    H    LYS 100           H        LYS 100  -6.974   8.020  -4.060
  806    HA   LYS 100           HA       LYS 100  -6.106  10.516  -5.134
  807    HB2  LYS 100           HB3      LYS 100  -8.192  10.985  -4.389
  808    HB3  LYS 100           HB2      LYS 100  -8.187   9.540  -3.321
  809    HG2  LYS 100           HG3      LYS 100  -6.830  10.849  -1.706
  810    HG3  LYS 100           HG2      LYS 100  -7.009  12.278  -2.706
  811    HD2  LYS 100           HD3      LYS 100  -9.176  10.744  -1.284
  812    HD3  LYS 100           HD2      LYS 100  -8.688  12.404  -1.060
  813    HE2  LYS 100           HE3      LYS 100  -9.795  11.431  -3.668
  814    HE3  LYS 100           HE2      LYS 100 -10.818  12.004  -2.378
  815    HZ1  LYS 100           HZ1      LYS 100  -9.379  13.519  -4.285
  816    HZ2  LYS 100           HZ2      LYS 100  -8.775  13.888  -2.748
  817    HZ3  LYS 100           HZ3      LYS 100 -10.452  14.093  -3.036
  818    H    ALA 101           H        ALA 101  -5.456   8.638  -2.273
  819    HA   ALA 101           HA       ALA 101  -4.082  10.463  -0.745
  820    HB1  ALA 101           HB1      ALA 101  -3.311   7.562  -0.773
  821    HB2  ALA 101           HB2      ALA 101  -4.926   8.060  -0.178
  822    HB3  ALA 101           HB3      ALA 101  -3.459   8.678   0.574
  823    H    THR 102           H        THR 102  -3.092   8.686  -3.525
  824    HA   THR 102           HA       THR 102  -0.342   9.604  -3.124
  825    HB   THR 102           HB       THR 102  -0.278   7.310  -3.746
  826    HG1  THR 102           HG1      THR 102   0.860   7.478  -5.538
  827   HG21  THR 102          HG21      THR 102  -2.737   7.897  -5.121
  828   HG22  THR 102          HG22      THR 102  -2.180   6.408  -4.395
  829   HG23  THR 102          HG23      THR 102  -1.647   6.847  -6.025
  830    H    ASN 103           H        ASN 103  -3.247  10.061  -4.785
  831    HA   ASN 103           HA       ASN 103  -2.246  12.478  -5.952
  832    HB2  ASN 103           HB3      ASN 103  -3.629  10.782  -7.964
  833    HB3  ASN 103           HB2      ASN 103  -2.390  12.012  -8.191
  834   HD21  ASN 103          HD21      ASN 103  -2.979   8.698  -7.217
  835   HD22  ASN 103          HD22      ASN 103  -1.381   8.122  -7.527
  836    H    GLU 104           H        GLU 104  -3.790  13.915  -5.229
  837    HA   GLU 104           HA       GLU 104  -6.237  14.501  -6.130
  838    HB2  GLU 104           HB3      GLU 104  -6.378  12.089  -4.366
  839    HB3  GLU 104           HB2      GLU 104  -7.665  13.280  -4.267
  840    HG2  GLU 104           HG3      GLU 104  -7.004  12.527  -6.974
  841    HG3  GLU 104           HG2      GLU 104  -7.575  11.213  -6.010
  842    HHA  HEC 201           HHA      HEC 201   5.076  -5.120   0.591
  843    HHB  HEC 201           HHB      HEC 201  -0.514  -2.432   0.407
  844    HHC  HEC 201           HHC      HEC 201  -2.149  -6.086   5.285
  845    HHD  HEC 201           HHD      HEC 201   3.974  -5.818   6.900
  846   HMA1  HEC 201          HMA1      HEC 201   0.833  -1.135  -1.159
  847   HMA2  HEC 201          HMA2      HEC 201   2.433  -0.292  -0.640
  848   HMA3  HEC 201          HMA3      HEC 201   2.246  -1.565  -1.460
  849   HAA1  HEC 201          HAA1      HEC 201   4.917  -2.996  -1.317
  850   HAA2  HEC 201          HAA2      HEC 201   5.500  -2.356   0.227
  851   HBA1  HEC 201          HBA1      HEC 201   4.025  -0.320  -0.186
  852   HBA2  HEC 201          HBA2      HEC 201   3.765  -0.949  -1.826
  853   HMB1  HEC 201          HMB1      HEC 201  -3.693  -1.925   2.092
  854   HMB2  HEC 201          HMB2      HEC 201  -3.771  -3.212   0.871
  855   HMB3  HEC 201          HMB3      HEC 201  -2.508  -1.956   0.765
  856    HAB  HEC 201           HAB      HEC 201  -4.007  -3.257   4.599
  857   HBB1  HEC 201          HBB1      HEC 201  -5.438  -5.229   2.807
  858   HBB2  HEC 201          HBB2      HEC 201  -4.795  -3.734   2.098
  859   HBB3  HEC 201          HBB3      HEC 201  -5.917  -3.652   3.485
  860   HMC1  HEC 201          HMC1      HEC 201  -1.020  -7.544   8.631
  861   HMC2  HEC 201          HMC2      HEC 201  -2.003  -7.685   7.033
  862   HMC3  HEC 201          HMC3      HEC 201  -0.656  -8.304   7.378
  863    HAC  HEC 201           HAC      HEC 201   2.908  -6.828   8.383
  864   HBC1  HEC 201          HBC1      HEC 201   3.181  -9.216   7.826
  865   HBC2  HEC 201          HBC2      HEC 201   1.529  -9.525   8.398
  866   HBC3  HEC 201          HBC3      HEC 201   2.782  -8.975   9.545
  867   HMD1  HEC 201          HMD1      HEC 201   5.903  -7.012   6.504
  868   HMD2  HEC 201          HMD2      HEC 201   7.046  -5.716   6.106
  869   HMD3  HEC 201          HMD3      HEC 201   7.147  -7.284   5.257
  870   HAD1  HEC 201          HAD1      HEC 201   7.855  -6.295   3.284
  871   HAD2  HEC 201          HAD2      HEC 201   7.448  -4.875   2.307
  872   HBD1  HEC 201          HBD1      HEC 201   7.770  -7.540   1.424
  873   HBD2  HEC 201          HBD2      HEC 201   7.229  -6.137   0.477
  Start of MODEL    9
    1    H1   GLY   1          1H        GLY   1 -19.485   4.011  -0.296
    2    H2   GLY   1          2H        GLY   1 -18.888   3.468  -1.782
    3    H3   GLY   1          3H        GLY   1 -19.048   5.126  -1.491
    4    HA2  GLY   1           HA2      GLY   1 -17.411   3.765   0.447
    5    HA3  GLY   1           HA3      GLY   1 -16.740   3.702  -1.186
    6    H    ASP   2           H        ASP   2 -16.686   5.377   1.663
    7    HA   ASP   2           HA       ASP   2 -16.098   7.916   0.221
    8    HB2  ASP   2           HB3      ASP   2 -16.691   7.650   3.231
    9    HB3  ASP   2           HB2      ASP   2 -16.724   9.130   2.183
   10    H    VAL   3           H        VAL   3 -14.286   9.176   1.072
   11    HA   VAL   3           HA       VAL   3 -11.936   7.666   1.390
   12    HB   VAL   3           HB       VAL   3 -12.611  10.555   1.502
   13   HG11  VAL   3          HG11      VAL   3 -11.302  10.630   3.418
   14   HG12  VAL   3          HG12      VAL   3 -10.145  10.969   2.101
   15   HG13  VAL   3          HG13      VAL   3 -10.214   9.364   2.840
   16   HG21  VAL   3          HG21      VAL   3 -11.896  10.287  -0.570
   17   HG22  VAL   3          HG22      VAL   3 -11.187   8.685  -0.164
   18   HG23  VAL   3          HG23      VAL   3 -10.283  10.197   0.157
   19    H    GLU   4           H        GLU   4 -13.947   9.411   3.721
   20    HA   GLU   4           HA       GLU   4 -12.296   9.152   6.026
   21    HB2  GLU   4           HB3      GLU   4 -14.207  10.632   6.058
   22    HB3  GLU   4           HB2      GLU   4 -15.305   9.294   5.802
   23    HG2  GLU   4           HG3      GLU   4 -14.414   8.364   8.025
   24    HG3  GLU   4           HG2      GLU   4 -13.708   9.979   8.219
   25    H    LYS   5           H        LYS   5 -14.882   7.033   4.784
   26    HA   LYS   5           HA       LYS   5 -14.709   5.104   6.846
   27    HB2  LYS   5           HB3      LYS   5 -15.567   4.657   4.033
   28    HB3  LYS   5           HB2      LYS   5 -15.986   3.628   5.405
   29    HG2  LYS   5           HG3      LYS   5 -16.847   6.090   6.199
   30    HG3  LYS   5           HG2      LYS   5 -17.234   6.096   4.444
   31    HD2  LYS   5           HD3      LYS   5 -17.878   3.619   5.892
   32    HD3  LYS   5           HD2      LYS   5 -18.799   5.019   6.375
   33    HE2  LYS   5           HE3      LYS   5 -20.086   4.834   4.600
   34    HE3  LYS   5           HE2      LYS   5 -18.672   5.058   3.572
   35    HZ1  LYS   5           HZ1      LYS   5 -20.202   2.761   3.972
   36    HZ2  LYS   5           HZ2      LYS   5 -18.624   2.443   4.455
   37    HZ3  LYS   5           HZ3      LYS   5 -18.925   3.021   2.891
   38    H    GLY   6           H        GLY   6 -13.019   5.454   3.767
   39    HA2  GLY   6           HA3      GLY   6 -11.771   2.905   3.707
   40    HA3  GLY   6           HA2      GLY   6 -11.227   4.377   2.887
   41    H    LYS   7           H        LYS   7 -10.729   6.004   5.050
   42    HA   LYS   7           HA       LYS   7  -8.140   5.263   5.721
   43    HB2  LYS   7           HB3      LYS   7  -8.532   7.548   5.895
   44    HB3  LYS   7           HB2      LYS   7 -10.066   7.360   6.815
   45    HG2  LYS   7           HG3      LYS   7  -7.911   6.284   8.354
   46    HG3  LYS   7           HG2      LYS   7  -7.516   7.919   7.822
   47    HD2  LYS   7           HD3      LYS   7 -10.216   8.008   8.576
   48    HD3  LYS   7           HD2      LYS   7  -9.424   6.972   9.784
   49    HE2  LYS   7           HE3      LYS   7  -8.907   8.857  10.831
   50    HE3  LYS   7           HE2      LYS   7  -7.607   8.930   9.642
   51    HZ1  LYS   7           HZ1      LYS   7  -8.515  10.992   9.279
   52    HZ2  LYS   7           HZ2      LYS   7 -10.065  10.499   9.774
   53    HZ3  LYS   7           HZ3      LYS   7  -9.554  10.093   8.225
   54    H    LYS   8           H        LYS   8 -11.134   4.984   7.607
   55    HA   LYS   8           HA       LYS   8  -9.903   3.934   9.963
   56    HB2  LYS   8           HB3      LYS   8 -12.011   3.799  10.754
   57    HB3  LYS   8           HB2      LYS   8 -12.420   4.772   9.370
   58    HG2  LYS   8           HG3      LYS   8 -13.995   3.112   9.139
   59    HG3  LYS   8           HG2      LYS   8 -12.646   2.432   8.188
   60    HD2  LYS   8           HD3      LYS   8 -14.005   1.341  10.431
   61    HD3  LYS   8           HD2      LYS   8 -12.662   0.646   9.521
   62    HE2  LYS   8           HE3      LYS   8 -11.067   1.951  10.923
   63    HE3  LYS   8           HE2      LYS   8 -12.443   2.505  11.901
   64    HZ1  LYS   8           HZ1      LYS   8 -11.132  -0.053  11.876
   65    HZ2  LYS   8           HZ2      LYS   8 -12.823  -0.104  11.989
   66    HZ3  LYS   8           HZ3      LYS   8 -11.902   0.743  13.127
   67    H    ILE   9           H        ILE   9 -11.269   2.335   7.094
   68    HA   ILE   9           HA       ILE   9 -11.019  -0.305   8.013
   69    HB   ILE   9           HB       ILE   9 -11.193   0.924   5.289
   70   HG12  ILE   9          HG13      ILE   9 -12.889  -1.025   6.863
   71   HG13  ILE   9          HG12      ILE   9 -13.249   0.670   6.550
   72   HG21  ILE   9          HG21      ILE   9 -10.925  -1.123   4.172
   73   HG22  ILE   9          HG22      ILE   9 -10.960  -2.045   5.673
   74   HG23  ILE   9          HG23      ILE   9  -9.566  -1.037   5.292
   75   HD11  ILE   9          HD11      ILE   9 -13.250   0.051   4.090
   76   HD12  ILE   9          HD12      ILE   9 -14.592  -0.541   5.069
   77   HD13  ILE   9          HD13      ILE   9 -13.274  -1.629   4.631
   78    H    PHE  10           H        PHE  10  -8.836   1.509   6.383
   79    HA   PHE  10           HA       PHE  10  -6.998  -0.618   6.163
   80    HB2  PHE  10           HB3      PHE  10  -6.461   0.805   4.507
   81    HB3  PHE  10           HB2      PHE  10  -7.153   2.183   5.347
   82    HD1  PHE  10           HD1      PHE  10  -4.177   1.183   3.736
   83    HD2  PHE  10           HD2      PHE  10  -5.703   3.078   7.153
   84    HE1  PHE  10           HE1      PHE  10  -1.895   1.824   4.341
   85    HE2  PHE  10           HE2      PHE  10  -3.425   3.725   7.765
   86    HZ   PHE  10           HZ       PHE  10  -1.518   3.097   6.358
   87    H    VAL  11           H        VAL  11  -7.328   1.964   8.382
   88    HA   VAL  11           HA       VAL  11  -4.854   1.951   9.574
   89    HB   VAL  11           HB       VAL  11  -7.547   2.460  10.827
   90   HG11  VAL  11          HG11      VAL  11  -6.527   3.299  12.748
   91   HG12  VAL  11          HG12      VAL  11  -4.936   3.365  11.990
   92   HG13  VAL  11          HG13      VAL  11  -5.641   1.809  12.423
   93   HG21  VAL  11          HG21      VAL  11  -7.436   4.385   9.729
   94   HG22  VAL  11          HG22      VAL  11  -5.861   3.947   9.065
   95   HG23  VAL  11          HG23      VAL  11  -5.964   4.783  10.615
   96    H    GLN  12           H        GLN  12  -7.714   0.178  10.728
   97    HA   GLN  12           HA       GLN  12  -6.044  -1.286  12.654
   98    HB2  GLN  12           HB3      GLN  12  -8.186  -2.668  12.954
   99    HB3  GLN  12           HB2      GLN  12  -8.301  -0.964  13.400
  100    HG2  GLN  12           HG3      GLN  12 -10.067  -0.882  12.090
  101    HG3  GLN  12           HG2      GLN  12  -9.038  -0.988  10.737
  102   HE21  GLN  12          HE21      GLN  12  -8.303  -3.748  11.440
  103   HE22  GLN  12          HE22      GLN  12  -9.625  -4.712  10.967
  104    H    LYS  13           H        LYS  13  -7.756  -1.806   9.783
  105    HA   LYS  13           HA       LYS  13  -7.561  -3.999   8.266
  106    HB2  LYS  13           HB3      LYS  13  -7.986  -2.379   7.108
  107    HB3  LYS  13           HB2      LYS  13  -6.611  -1.426   7.707
  108    HG2  LYS  13           HG3      LYS  13  -6.111  -2.097   5.519
  109    HG3  LYS  13           HG2      LYS  13  -5.268  -3.302   6.548
  110    HD2  LYS  13           HD3      LYS  13  -6.446  -5.053   5.570
  111    HD3  LYS  13           HD2      LYS  13  -7.991  -4.294   5.986
  112    HE2  LYS  13           HE3      LYS  13  -7.124  -2.803   3.842
  113    HE3  LYS  13           HE2      LYS  13  -6.758  -4.660   3.480
  114    HZ1  LYS  13           HZ1      LYS  13  -9.316  -3.921   4.338
  115    HZ2  LYS  13           HZ2      LYS  13  -8.727  -5.287   3.491
  116    HZ3  LYS  13           HZ3      LYS  13  -8.883  -3.775   2.699
  117    H    CYS  14           H        CYS  14  -4.581  -2.314   8.935
  118    HA   CYS  14           HA       CYS  14  -2.917  -4.409   9.561
  119    HB2  CYS  14           HB3      CYS  14  -1.544  -4.847   7.681
  120    HB3  CYS  14           HB2      CYS  14  -3.216  -5.512   7.526
  121    H    ALA  15           H        ALA  15  -3.562  -1.302   9.526
  122    HA   ALA  15           HA       ALA  15  -1.326   0.081   8.625
  123    HB1  ALA  15           HB1      ALA  15  -2.728   0.795  11.205
  124    HB2  ALA  15           HB2      ALA  15  -3.512   0.952   9.594
  125    HB3  ALA  15           HB3      ALA  15  -2.033   1.847   9.943
  126    H    GLN  16           H        GLN  16  -1.449  -2.163  11.595
  127    HA   GLN  16           HA       GLN  16   0.809  -1.194  12.952
  128    HB2  GLN  16           HB3      GLN  16   0.473  -4.111  12.920
  129    HB3  GLN  16           HB2      GLN  16   0.542  -2.987  14.271
  130    HG2  GLN  16           HG3      GLN  16  -1.852  -2.328  13.613
  131    HG3  GLN  16           HG2      GLN  16  -1.853  -3.741  12.608
  132   HE21  GLN  16          HE21      GLN  16  -0.669  -3.030  15.847
  133   HE22  GLN  16          HE22      GLN  16  -1.531  -4.314  16.655
  134    H    CYS  17           H        CYS  17   0.629  -3.386  10.212
  135    HA   CYS  17           HA       CYS  17   3.394  -4.035  10.267
  136    HB2  CYS  17           HB3      CYS  17   1.563  -4.346   7.857
  137    HB3  CYS  17           HB2      CYS  17   2.945  -5.348   8.332
  138    H    HIS  18           H        HIS  18   1.487  -1.464   9.026
  139    HA   HIS  18           HA       HIS  18   3.717  -0.528   7.344
  140    HB2  HIS  18           HB3      HIS  18   0.820   0.330   7.249
  141    HB3  HIS  18           HB2      HIS  18   2.093   0.844   6.146
  142    HD1  HIS  18           HD1      HIS  18   1.813  -0.318   3.964
  143    HD2  HIS  18           HD2      HIS  18   0.832  -2.798   7.177
  144    HE1  HIS  18           HE1      HIS  18   1.204  -2.504   2.953
  145    H    THR  19           H        THR  19   3.203  -0.245  10.327
  146    HA   THR  19           HA       THR  19   3.403   1.319  11.966
  147    HB   THR  19           HB       THR  19   4.845   2.809   9.827
  148    HG1  THR  19           HG1      THR  19   6.664   1.746  10.572
  149   HG21  THR  19          HG21      THR  19   5.277   2.877  12.799
  150   HG22  THR  19          HG22      THR  19   4.409   4.128  11.887
  151   HG23  THR  19          HG23      THR  19   6.123   3.883  11.557
  152    H    VAL  20           H        VAL  20   2.780   3.426  12.691
  153    HA   VAL  20           HA       VAL  20   0.292   4.339  11.372
  154    HB   VAL  20           HB       VAL  20   1.462   5.634  13.860
  155   HG11  VAL  20          HG11      VAL  20  -0.727   6.327  12.488
  156   HG12  VAL  20          HG12      VAL  20  -0.784   6.260  14.289
  157   HG13  VAL  20          HG13      VAL  20  -1.484   4.937  13.283
  158   HG21  VAL  20          HG21      VAL  20   0.369   3.911  15.221
  159   HG22  VAL  20          HG22      VAL  20   1.668   3.175  14.137
  160   HG23  VAL  20          HG23      VAL  20  -0.140   3.026  13.783
  161    H    GLU  21           H        GLU  21   0.849   7.042  12.749
  162    HA   GLU  21           HA       GLU  21   1.591   8.477  10.394
  163    HB2  GLU  21           HB3      GLU  21   1.950  10.008  12.799
  164    HB3  GLU  21           HB2      GLU  21   0.761  10.216  11.519
  165    HG2  GLU  21           HG3      GLU  21  -0.700   8.560  12.518
  166    HG3  GLU  21           HG2      GLU  21   0.459   8.359  13.833
  167    H    LYS  22           H        LYS  22   3.528   9.557   9.845
  168    HA   LYS  22           HA       LYS  22   5.943   8.396  10.368
  169    HB2  LYS  22           HB3      LYS  22   5.276  10.097   8.576
  170    HB3  LYS  22           HB2      LYS  22   5.699  11.334   9.751
  171    HG2  LYS  22           HG3      LYS  22   7.532   9.225   8.523
  172    HG3  LYS  22           HG2      LYS  22   7.578  10.993   8.336
  173    HD2  LYS  22           HD3      LYS  22   8.099   9.477  10.869
  174    HD3  LYS  22           HD2      LYS  22   9.292  10.273   9.899
  175    HE2  LYS  22           HE3      LYS  22   8.397  12.423  10.313
  176    HE3  LYS  22           HE2      LYS  22   6.996  11.715  11.161
  177    HZ1  LYS  22           HZ1      LYS  22   9.487  12.452  12.202
  178    HZ2  LYS  22           HZ2      LYS  22   9.341  10.760  12.376
  179    HZ3  LYS  22           HZ3      LYS  22   8.196  11.777  13.022
  180    H    GLY  23           H        GLY  23   7.195   8.326  12.146
  181    HA2  GLY  23           HA3      GLY  23   8.315  10.132  13.644
  182    HA3  GLY  23           HA2      GLY  23   6.693  10.219  14.327
  183    H    GLY  24           H        GLY  24   6.243   7.332  13.902
  184    HA2  GLY  24           HA3      GLY  24   7.380   6.440  16.383
  185    HA3  GLY  24           HA2      GLY  24   6.268   5.521  15.335
  186    H    LYS  25           H        LYS  25   7.225   3.646  14.821
  187    HA   LYS  25           HA       LYS  25  10.078   3.613  14.133
  188    HB2  LYS  25           HB3      LYS  25   8.903   1.026  14.573
  189    HB3  LYS  25           HB2      LYS  25  10.298   1.737  15.267
  190    HG2  LYS  25           HG3      LYS  25   9.168   2.493  17.107
  191    HG3  LYS  25           HG2      LYS  25   7.657   2.693  16.205
  192    HD2  LYS  25           HD3      LYS  25   8.878   0.054  17.070
  193    HD3  LYS  25           HD2      LYS  25   7.439   0.852  17.775
  194    HE2  LYS  25           HE3      LYS  25   6.117  -0.096  16.265
  195    HE3  LYS  25           HE2      LYS  25   7.088   0.649  14.972
  196    HZ1  LYS  25           HZ1      LYS  25   7.064  -2.088  15.967
  197    HZ2  LYS  25           HZ2      LYS  25   8.618  -1.428  15.749
  198    HZ3  LYS  25           HZ3      LYS  25   7.587  -1.449  14.453
  199    H    HIS  26           H        HIS  26  10.734   2.281  12.369
  200    HA   HIS  26           HA       HIS  26   9.177   2.542  10.073
  201    HB2  HIS  26           HB3      HIS  26  11.045   0.473   9.680
  202    HB3  HIS  26           HB2      HIS  26  11.107   2.121   9.061
  203    HD1  HIS  26           HD1      HIS  26  11.829   0.377  12.421
  204    HD2  HIS  26           HD2      HIS  26  13.371   3.317   9.888
  205    HE1  HIS  26           HE1      HIS  26  13.932   1.203  13.565
  206    HE2  HIS  26           HE2      HIS  26  14.781   3.029  12.037
  207    H    LYS  27           H        LYS  27   7.901   1.152   8.929
  208    HA   LYS  27           HA       LYS  27   6.783  -1.081  10.415
  209    HB2  LYS  27           HB3      LYS  27   4.965  -0.942   9.049
  210    HB3  LYS  27           HB2      LYS  27   5.549   0.759   8.981
  211    HG2  LYS  27           HG3      LYS  27   6.875  -0.458   6.924
  212    HG3  LYS  27           HG2      LYS  27   5.239  -1.196   6.838
  213    HD2  LYS  27           HD3      LYS  27   5.708   0.963   5.514
  214    HD3  LYS  27           HD2      LYS  27   4.248   0.907   6.509
  215    HE2  LYS  27           HE3      LYS  27   4.934   2.558   7.806
  216    HE3  LYS  27           HE2      LYS  27   6.499   1.858   8.023
  217    HZ1  LYS  27           HZ1      LYS  27   7.298   2.843   6.085
  218    HZ2  LYS  27           HZ2      LYS  27   6.497   4.055   6.916
  219    HZ3  LYS  27           HZ3      LYS  27   5.758   3.345   5.569
  220    H    THR  28           H        THR  28   6.177  -3.020   8.988
  221    HA   THR  28           HA       THR  28   8.591  -4.291   8.181
  222    HB   THR  28           HB       THR  28   5.968  -5.459   7.386
  223    HG1  THR  28           HG1      THR  28   6.811  -5.500  10.069
  224   HG21  THR  28          HG21      THR  28   6.889  -7.534   7.890
  225   HG22  THR  28          HG22      THR  28   8.113  -6.768   9.008
  226   HG23  THR  28          HG23      THR  28   8.265  -6.647   7.235
  227    H    GLY  29           H        GLY  29   5.849  -2.897   6.417
  228    HA2  GLY  29           HA3      GLY  29   7.500  -3.009   3.960
  229    HA3  GLY  29           HA2      GLY  29   5.799  -3.546   3.930
  230    HA   PRO  30           HA       PRO  30   6.698   1.265   3.250
  231    HB2  PRO  30           HB3      PRO  30   5.647   0.358   0.535
  232    HB3  PRO  30           HB2      PRO  30   6.769   1.662   0.909
  233    HG2  PRO  30           HG3      PRO  30   7.690  -0.675  -0.024
  234    HG3  PRO  30           HG2      PRO  30   8.565   0.241   1.198
  235    HD2  PRO  30           HD3      PRO  30   6.951  -2.248   1.582
  236    HD3  PRO  30           HD2      PRO  30   8.336  -1.725   2.542
  237    H    ASN  31           H        ASN  31   5.051   2.300   4.170
  238    HA   ASN  31           HA       ASN  31   2.535   1.313   4.534
  239    HB2  ASN  31           HB3      ASN  31   3.819   3.406   5.544
  240    HB3  ASN  31           HB2      ASN  31   2.846   4.276   4.335
  241   HD21  ASN  31          HD21      ASN  31   2.194   5.165   6.556
  242   HD22  ASN  31          HD22      ASN  31   0.697   4.490   7.252
  243    H    LEU  32           H        LEU  32   3.419   4.009   2.221
  244    HA   LEU  32           HA       LEU  32   1.937   2.949   0.185
  245    HB2  LEU  32           HB3      LEU  32   0.040   4.458  -0.149
  246    HB3  LEU  32           HB2      LEU  32   0.004   3.498   1.320
  247    HG   LEU  32           HG       LEU  32  -1.032   5.627   1.883
  248   HD11  LEU  32          HD11      LEU  32   1.632   5.255   2.824
  249   HD12  LEU  32          HD12      LEU  32   0.205   4.574   3.603
  250   HD13  LEU  32          HD13      LEU  32   0.472   6.316   3.624
  251   HD21  LEU  32          HD21      LEU  32  -0.259   7.589   1.121
  252   HD22  LEU  32          HD22      LEU  32   0.411   6.513  -0.105
  253   HD23  LEU  32          HD23      LEU  32   1.402   7.031   1.265
  254    H    HIS  33           H        HIS  33   3.442   5.658   1.721
  255    HA   HIS  33           HA       HIS  33   3.538   7.592  -0.199
  256    HB2  HIS  33           HB3      HIS  33   4.839   7.092   2.195
  257    HB3  HIS  33           HB2      HIS  33   6.141   7.283   1.027
  258    HD1  HIS  33           HD1      HIS  33   6.787   9.512   2.241
  259    HD2  HIS  33           HD2      HIS  33   3.047   9.509   0.517
  260    HE1  HIS  33           HE1      HIS  33   6.101  11.914   2.156
  261    HE2  HIS  33           HE2      HIS  33   3.784  11.894   1.193
  262    H    GLY  34           H        GLY  34   4.294   7.719  -2.232
  263    HA2  GLY  34           HA3      GLY  34   5.605   7.336  -4.060
  264    HA3  GLY  34           HA2      GLY  34   6.764   6.540  -3.038
  265    H    LEU  35           H        LEU  35   3.597   5.344  -2.867
  266    HA   LEU  35           HA       LEU  35   4.274   2.749  -3.648
  267    HB2  LEU  35           HB3      LEU  35   2.347   3.361  -2.180
  268    HB3  LEU  35           HB2      LEU  35   1.520   4.006  -3.616
  269    HG   LEU  35           HG       LEU  35   1.437   1.771  -4.632
  270   HD11  LEU  35          HD11      LEU  35   2.571  -0.105  -3.919
  271   HD12  LEU  35          HD12      LEU  35   2.484   0.428  -2.203
  272   HD13  LEU  35          HD13      LEU  35   3.686   1.195  -3.200
  273   HD21  LEU  35          HD21      LEU  35   0.383   2.124  -1.817
  274   HD22  LEU  35          HD22      LEU  35   0.059   0.626  -2.687
  275   HD23  LEU  35          HD23      LEU  35  -0.516   2.154  -3.309
  276    H    PHE  36           H        PHE  36   2.529   5.313  -5.363
  277    HA   PHE  36           HA       PHE  36   2.859   3.760  -7.862
  278    HB2  PHE  36           HB3      PHE  36   0.938   6.091  -7.766
  279    HB3  PHE  36           HB2      PHE  36   0.781   4.621  -8.668
  280    HD1  PHE  36           HD1      PHE  36  -0.274   2.585  -7.729
  281    HD2  PHE  36           HD2      PHE  36   0.295   6.228  -5.437
  282    HE1  PHE  36           HE1      PHE  36  -1.851   1.760  -6.012
  283    HE2  PHE  36           HE2      PHE  36  -1.290   5.369  -3.703
  284    HZ   PHE  36           HZ       PHE  36  -2.314   3.156  -3.988
  285    H    GLY  37           H        GLY  37   4.604   5.847  -6.315
  286    HA2  GLY  37           HA3      GLY  37   5.149   7.519  -8.722
  287    HA3  GLY  37           HA2      GLY  37   5.300   8.146  -7.041
  288    H    ARG  38           H        ARG  38   6.484   5.851  -5.862
  289    HA   ARG  38           HA       ARG  38   9.194   6.309  -6.854
  290    HB2  ARG  38           HB3      ARG  38   8.134   4.885  -4.384
  291    HB3  ARG  38           HB2      ARG  38   9.842   4.955  -4.785
  292    HG2  ARG  38           HG3      ARG  38   9.502   7.500  -4.839
  293    HG3  ARG  38           HG2      ARG  38   7.951   7.222  -4.053
  294    HD2  ARG  38           HD3      ARG  38   8.953   6.920  -2.048
  295    HD3  ARG  38           HD2      ARG  38  10.003   5.678  -2.725
  296    HE   ARG  38           HE       ARG  38  11.622   7.266  -2.462
  297   HH11  ARG  38          HH11      ARG  38   8.704   8.852  -3.469
  298   HH12  ARG  38          HH12      ARG  38   9.473  10.425  -3.587
  299   HH21  ARG  38          HH21      ARG  38  12.599   9.309  -2.551
  300   HH22  ARG  38          HH22      ARG  38  11.688  10.684  -3.065
  301    H    LYS  39           H        LYS  39  10.688   4.324  -6.868
  302    HA   LYS  39           HA       LYS  39   9.927   2.561  -8.847
  303    HB2  LYS  39           HB3      LYS  39  12.301   2.996  -8.230
  304    HB3  LYS  39           HB2      LYS  39  12.051   2.119  -6.731
  305    HG2  LYS  39           HG3      LYS  39  13.057   1.095  -9.058
  306    HG3  LYS  39           HG2      LYS  39  12.311   0.120  -7.771
  307    HD2  LYS  39           HD3      LYS  39  11.339  -0.506  -9.944
  308    HD3  LYS  39           HD2      LYS  39  10.161   0.254  -8.905
  309    HE2  LYS  39           HE3      LYS  39  10.728   2.445 -10.049
  310    HE3  LYS  39           HE2      LYS  39  11.505   1.432 -11.262
  311    HZ1  LYS  39           HZ1      LYS  39   9.525   0.636 -12.030
  312    HZ2  LYS  39           HZ2      LYS  39   9.010   2.146 -11.430
  313    HZ3  LYS  39           HZ3      LYS  39   8.766   0.724 -10.520
  314    H    THR  40           H        THR  40  11.025   0.895  -5.999
  315    HA   THR  40           HA       THR  40   8.460   0.029  -5.209
  316    HB   THR  40           HB       THR  40   8.959  -2.239  -4.982
  317    HG1  THR  40           HG1      THR  40  10.439  -3.434  -5.886
  318   HG21  THR  40          HG21      THR  40   8.637  -1.997  -7.733
  319   HG22  THR  40          HG22      THR  40   8.923  -2.834  -6.522
  320   HG23  THR  40          HG23      THR  40   7.532  -2.852  -6.219
  321    H    GLY  41           H        GLY  41   8.396   0.418  -3.439
  322    HA2  GLY  41           HA3      GLY  41   8.850   0.417  -1.169
  323    HA3  GLY  41           HA2      GLY  41   9.530  -1.207  -1.495
  324    H    GLN  42           H        GLN  42  10.769   1.832  -2.795
  325    HA   GLN  42           HA       GLN  42  13.323   1.287  -1.486
  326    HB2  GLN  42           HB3      GLN  42  13.828   3.317  -3.240
  327    HB3  GLN  42           HB2      GLN  42  14.036   1.603  -3.560
  328    HG2  GLN  42           HG3      GLN  42  12.843   2.810  -5.355
  329    HG3  GLN  42           HG2      GLN  42  11.910   1.499  -4.652
  330   HE21  GLN  42          HE21      GLN  42   9.846   2.005  -4.637
  331   HE22  GLN  42          HE22      GLN  42   9.203   3.516  -4.145
  332    H    ALA  43           H        ALA  43  11.357   2.294   0.186
  333    HA   ALA  43           HA       ALA  43  11.173   5.062   0.394
  334    HB1  ALA  43           HB1      ALA  43  11.271   4.205   3.052
  335    HB2  ALA  43           HB2      ALA  43  10.759   2.749   2.146
  336    HB3  ALA  43           HB3      ALA  43   9.834   4.294   2.033
  337    HA   PRO  44           HA       PRO  44  15.019   6.498   2.014
  338    HB2  PRO  44           HB3      PRO  44  14.405   8.188   4.017
  339    HB3  PRO  44           HB2      PRO  44  13.928   8.486   2.371
  340    HG2  PRO  44           HG3      PRO  44  12.342   7.347   4.636
  341    HG3  PRO  44           HG2      PRO  44  11.830   8.549   3.430
  342    HD2  PRO  44           HD3      PRO  44  11.205   5.895   3.225
  343    HD3  PRO  44           HD2      PRO  44  11.328   6.983   1.829
  344    H    GLY  45           H        GLY  45  14.146   7.045   5.250
  345    HA2  GLY  45           HA3      GLY  45  16.155   5.271   6.236
  346    HA3  GLY  45           HA2      GLY  45  15.018   6.192   7.228
  347    H    PHE  46           H        PHE  46  13.297   4.407   4.983
  348    HA   PHE  46           HA       PHE  46  12.395   2.592   7.029
  349    HB2  PHE  46           HB3      PHE  46  10.761   3.624   5.520
  350    HB3  PHE  46           HB2      PHE  46  11.598   2.888   4.140
  351    HD1  PHE  46           HD1      PHE  46   9.770   2.106   7.299
  352    HD2  PHE  46           HD2      PHE  46  10.943   0.729   3.450
  353    HE1  PHE  46           HE1      PHE  46   8.285   0.161   7.535
  354    HE2  PHE  46           HE2      PHE  46   9.458  -1.230   3.704
  355    HZ   PHE  46           HZ       PHE  46   8.143  -1.514   5.735
  356    H    THR  47           H        THR  47  12.820   0.459   7.221
  357    HA   THR  47           HA       THR  47  14.974  -0.623   5.712
  358    HB   THR  47           HB       THR  47  14.029  -1.010   8.250
  359    HG1  THR  47           HG1      THR  47  15.714  -2.552   8.364
  360   HG21  THR  47          HG21      THR  47  13.715  -3.487   8.347
  361   HG22  THR  47          HG22      THR  47  13.415  -3.445   6.604
  362   HG23  THR  47          HG23      THR  47  12.364  -2.555   7.725
  363    H    TYR  48           H        TYR  48  14.452  -1.105   3.687
  364    HA   TYR  48           HA       TYR  48  11.966  -2.262   2.919
  365    HB2  TYR  48           HB3      TYR  48  13.876  -2.724   0.869
  366    HB3  TYR  48           HB2      TYR  48  12.621  -1.461   0.881
  367    HD1  TYR  48           HD1      TYR  48  16.044  -2.099   2.285
  368    HD2  TYR  48           HD2      TYR  48  13.240   0.754   0.790
  369    HE1  TYR  48           HE1      TYR  48  17.766  -0.347   2.337
  370    HE2  TYR  48           HE2      TYR  48  14.981   2.494   0.864
  371    HH   TYR  48           HH       TYR  48  18.089   2.003   2.397
  372    H    THR  49           H        THR  49  11.660  -4.283   1.801
  373    HA   THR  49           HA       THR  49  12.945  -6.456   3.233
  374    HB   THR  49           HB       THR  49  11.308  -7.884   2.158
  375    HG1  THR  49           HG1      THR  49   9.881  -6.793   0.540
  376   HG21  THR  49          HG21      THR  49   9.445  -5.709   2.300
  377   HG22  THR  49          HG22      THR  49  10.511  -5.740   3.705
  378   HG23  THR  49          HG23      THR  49   9.564  -7.158   3.285
  379    H    ASP  50           H        ASP  50  13.605  -8.467   1.820
  380    HA   ASP  50           HA       ASP  50  15.887  -7.778   0.401
  381    HB2  ASP  50           HB3      ASP  50  15.875 -10.011   1.043
  382    HB3  ASP  50           HB2      ASP  50  14.184 -10.262   0.623
  383    H    ALA  51           H        ALA  51  12.581  -8.237  -0.695
  384    HA   ALA  51           HA       ALA  51  13.132  -8.178  -3.522
  385    HB1  ALA  51           HB1      ALA  51  11.007  -8.802  -3.650
  386    HB2  ALA  51           HB2      ALA  51  10.516  -7.241  -2.959
  387    HB3  ALA  51           HB3      ALA  51  10.853  -8.582  -1.907
  388    H    ASN  52           H        ASN  52  12.040  -5.701  -1.178
  389    HA   ASN  52           HA       ASN  52  11.744  -3.586  -2.996
  390    HB2  ASN  52           HB3      ASN  52  12.445  -3.564  -0.042
  391    HB3  ASN  52           HB2      ASN  52  11.972  -2.127  -0.972
  392   HD21  ASN  52          HD21      ASN  52  10.179  -4.193  -2.450
  393   HD22  ASN  52          HD22      ASN  52   8.771  -4.251  -1.450
  394    H    LYS  53           H        LYS  53  14.523  -4.637  -1.073
  395    HA   LYS  53           HA       LYS  53  16.271  -2.538  -1.764
  396    HB2  LYS  53           HB3      LYS  53  18.106  -4.275  -1.256
  397    HB3  LYS  53           HB2      LYS  53  16.944  -3.934   0.077
  398    HG2  LYS  53           HG3      LYS  53  15.802  -6.003  -0.391
  399    HG3  LYS  53           HG2      LYS  53  16.719  -6.275  -1.897
  400    HD2  LYS  53           HD3      LYS  53  17.884  -7.626  -0.409
  401    HD3  LYS  53           HD2      LYS  53  18.766  -6.120  -0.155
  402    HE2  LYS  53           HE3      LYS  53  18.218  -6.189   1.999
  403    HE3  LYS  53           HE2      LYS  53  16.505  -6.096   1.608
  404    HZ1  LYS  53           HZ1      LYS  53  18.006  -8.321   2.533
  405    HZ2  LYS  53           HZ2      LYS  53  17.154  -8.733   1.129
  406    HZ3  LYS  53           HZ3      LYS  53  16.330  -8.098   2.465
  407    H    ASN  54           H        ASN  54  15.289  -5.447  -3.407
  408    HA   ASN  54           HA       ASN  54  17.330  -5.350  -5.428
  409    HB2  ASN  54           HB3      ASN  54  14.697  -6.809  -5.410
  410    HB3  ASN  54           HB2      ASN  54  16.035  -7.092  -6.567
  411   HD21  ASN  54          HD21      ASN  54  17.384  -6.367  -3.659
  412   HD22  ASN  54          HD22      ASN  54  17.623  -7.958  -3.059
  413    H    LYS  55           H        LYS  55  14.445  -3.695  -4.855
  414    HA   LYS  55           HA       LYS  55  13.418  -2.004  -5.948
  415    HB2  LYS  55           HB3      LYS  55  15.689  -2.454  -7.839
  416    HB3  LYS  55           HB2      LYS  55  14.456  -1.278  -8.211
  417    HG2  LYS  55           HG3      LYS  55  15.271   0.211  -6.760
  418    HG3  LYS  55           HG2      LYS  55  15.596  -1.029  -5.509
  419    HD2  LYS  55           HD3      LYS  55  17.289  -0.159  -7.851
  420    HD3  LYS  55           HD2      LYS  55  17.679  -0.135  -6.104
  421    HE2  LYS  55           HE3      LYS  55  17.302  -2.774  -6.294
  422    HE3  LYS  55           HE2      LYS  55  17.606  -2.496  -8.038
  423    HZ1  LYS  55           HZ1      LYS  55  19.658  -2.956  -7.129
  424    HZ2  LYS  55           HZ2      LYS  55  19.435  -2.043  -5.762
  425    HZ3  LYS  55           HZ3      LYS  55  19.668  -1.282  -7.220
  426    H    GLY  56           H        GLY  56  11.923  -4.059  -6.055
  427    HA2  GLY  56           HA3      GLY  56  11.501  -5.532  -8.366
  428    HA3  GLY  56           HA2      GLY  56  10.248  -5.122  -7.205
  429    H    ILE  57           H        ILE  57   8.670  -3.753  -7.782
  430    HA   ILE  57           HA       ILE  57   9.197  -1.926  -9.965
  431    HB   ILE  57           HB       ILE  57   8.018  -4.322 -10.587
  432   HG12  ILE  57          HG13      ILE  57   8.936  -3.148 -12.349
  433   HG13  ILE  57          HG12      ILE  57   7.204  -2.800 -12.612
  434   HG21  ILE  57          HG21      ILE  57   5.968  -3.951  -9.564
  435   HG22  ILE  57          HG22      ILE  57   5.690  -3.561 -11.266
  436   HG23  ILE  57          HG23      ILE  57   5.879  -2.263 -10.088
  437   HD11  ILE  57          HD11      ILE  57   7.456  -0.673 -12.103
  438   HD12  ILE  57          HD12      ILE  57   9.094  -0.932 -12.563
  439   HD13  ILE  57          HD13      ILE  57   8.678  -0.957 -10.846
  440    H    THR  58           H        THR  58   7.183  -0.531 -10.403
  441    HA   THR  58           HA       THR  58   6.332   0.514  -7.879
  442    HB   THR  58           HB       THR  58   6.767   1.607 -10.489
  443    HG1  THR  58           HG1      THR  58   6.287   3.589  -9.375
  444   HG21  THR  58          HG21      THR  58   4.410   1.090 -11.035
  445   HG22  THR  58          HG22      THR  58   4.774   2.788 -10.999
  446   HG23  THR  58          HG23      THR  58   3.905   2.076  -9.673
  447    H    TRP  59           H        TRP  59   4.632  -0.256  -6.867
  448    HA   TRP  59           HA       TRP  59   2.712  -1.942  -8.042
  449    HB2  TRP  59           HB3      TRP  59   2.007  -0.548  -5.517
  450    HB3  TRP  59           HB2      TRP  59   1.989  -2.282  -5.873
  451    HD1  TRP  59           HD1      TRP  59   4.457   0.573  -4.834
  452    HE1  TRP  59           HE1      TRP  59   6.495  -0.551  -3.733
  453    HE3  TRP  59           HE3      TRP  59   3.271  -4.378  -5.619
  454    HZ2  TRP  59           HZ2      TRP  59   7.502  -3.185  -3.265
  455    HZ3  TRP  59           HZ3      TRP  59   4.849  -6.103  -4.826
  456    HH2  TRP  59           HH2      TRP  59   6.907  -5.508  -3.654
  457    H    LYS  60           H        LYS  60   1.276  -1.232  -9.457
  458    HA   LYS  60           HA       LYS  60   0.059   1.408  -9.189
  459    HB2  LYS  60           HB3      LYS  60   0.396   1.577 -11.351
  460    HB3  LYS  60           HB2      LYS  60   0.991  -0.089 -11.443
  461    HG2  LYS  60           HG3      LYS  60  -0.732  -0.368 -12.822
  462    HG3  LYS  60           HG2      LYS  60  -1.697  -0.551 -11.317
  463    HD2  LYS  60           HD3      LYS  60  -2.793   1.405 -11.694
  464    HD3  LYS  60           HD2      LYS  60  -1.313   2.192 -12.238
  465    HE2  LYS  60           HE3      LYS  60  -1.994   0.330 -14.178
  466    HE3  LYS  60           HE2      LYS  60  -3.436   1.207 -13.771
  467    HZ1  LYS  60           HZ1      LYS  60  -1.498   2.069 -15.498
  468    HZ2  LYS  60           HZ2      LYS  60  -1.171   2.912 -14.057
  469    HZ3  LYS  60           HZ3      LYS  60  -2.676   3.040 -14.753
  470    H    GLU  61           H        GLU  61  -2.292   1.471 -10.039
  471    HA   GLU  61           HA       GLU  61  -3.884  -0.029  -8.256
  472    HB2  GLU  61           HB3      GLU  61  -4.252   2.185  -9.927
  473    HB3  GLU  61           HB2      GLU  61  -5.353   0.936 -10.610
  474    HG2  GLU  61           HG3      GLU  61  -5.648   0.922  -7.804
  475    HG3  GLU  61           HG2      GLU  61  -5.761   2.588  -8.342
  476    H    GLU  62           H        GLU  62  -3.689  -0.247 -11.855
  477    HA   GLU  62           HA       GLU  62  -5.288  -2.561 -12.074
  478    HB2  GLU  62           HB3      GLU  62  -4.784  -2.453 -14.333
  479    HB3  GLU  62           HB2      GLU  62  -4.390  -0.818 -13.843
  480    HG2  GLU  62           HG3      GLU  62  -2.045  -1.487 -13.689
  481    HG3  GLU  62           HG2      GLU  62  -2.452  -3.054 -14.231
  482    H    THR  63           H        THR  63  -1.738  -2.157 -11.817
  483    HA   THR  63           HA       THR  63  -1.078  -4.868 -12.203
  484    HB   THR  63           HB       THR  63   0.302  -2.490 -11.704
  485    HG1  THR  63           HG1      THR  63   1.625  -3.513 -12.919
  486   HG21  THR  63          HG21      THR  63   1.829  -2.821  -9.985
  487   HG22  THR  63          HG22      THR  63   1.493  -4.566  -9.973
  488   HG23  THR  63          HG23      THR  63   0.331  -3.447  -9.322
  489    H    LEU  64           H        LEU  64  -2.190  -3.070  -9.474
  490    HA   LEU  64           HA       LEU  64  -1.452  -4.980  -7.492
  491    HB2  LEU  64           HB3      LEU  64  -2.914  -2.494  -7.604
  492    HB3  LEU  64           HB2      LEU  64  -3.613  -3.581  -6.475
  493    HG   LEU  64           HG       LEU  64  -0.763  -2.588  -6.465
  494   HD11  LEU  64          HD11      LEU  64  -1.844  -0.836  -5.523
  495   HD12  LEU  64          HD12      LEU  64  -1.763  -1.872  -4.097
  496   HD13  LEU  64          HD13      LEU  64  -3.241  -1.805  -5.055
  497   HD21  LEU  64          HD21      LEU  64  -0.507  -3.857  -4.408
  498   HD22  LEU  64          HD22      LEU  64  -1.014  -4.946  -5.699
  499   HD23  LEU  64          HD23      LEU  64  -2.151  -4.456  -4.492
  500    H    MET  65           H        MET  65  -4.295  -4.451  -9.495
  501    HA   MET  65           HA       MET  65  -6.078  -6.157  -8.196
  502    HB2  MET  65           HB3      MET  65  -5.806  -5.331 -11.084
  503    HB3  MET  65           HB2      MET  65  -7.119  -6.336 -10.544
  504    HG2  MET  65           HG3      MET  65  -6.516  -3.513  -9.738
  505    HG3  MET  65           HG2      MET  65  -7.925  -4.112 -10.627
  506    HE1  MET  65           HE1      MET  65  -6.462  -3.036  -7.416
  507    HE2  MET  65           HE2      MET  65  -6.023  -4.748  -7.158
  508    HE3  MET  65           HE3      MET  65  -7.225  -3.980  -6.111
  509    H    GLU  66           H        GLU  66  -3.671  -6.797 -10.706
  510    HA   GLU  66           HA       GLU  66  -4.333  -9.592 -10.879
  511    HB2  GLU  66           HB3      GLU  66  -2.106  -9.654 -12.196
  512    HB3  GLU  66           HB2      GLU  66  -3.455  -8.736 -12.901
  513    HG2  GLU  66           HG3      GLU  66  -2.541  -6.652 -12.115
  514    HG3  GLU  66           HG2      GLU  66  -1.224  -7.494 -11.296
  515    H    TYR  67           H        TYR  67  -1.918  -7.602  -9.292
  516    HA   TYR  67           HA       TYR  67  -0.224  -9.676  -8.409
  517    HB2  TYR  67           HB3      TYR  67   0.811  -7.630  -8.065
  518    HB3  TYR  67           HB2      TYR  67  -0.769  -6.855  -7.653
  519    HD1  TYR  67           HD1      TYR  67   2.166  -8.582  -6.359
  520    HD2  TYR  67           HD2      TYR  67  -1.640  -6.960  -5.348
  521    HE1  TYR  67           HE1      TYR  67   2.782  -8.675  -3.971
  522    HE2  TYR  67           HE2      TYR  67  -1.062  -7.041  -2.958
  523    HH   TYR  67           HH       TYR  67   0.762  -7.200  -1.508
  524    H    LEU  68           H        LEU  68  -3.379  -8.647  -7.335
  525    HA   LEU  68           HA       LEU  68  -3.319  -9.535  -4.670
  526    HB2  LEU  68           HB3      LEU  68  -5.490  -9.150  -6.729
  527    HB3  LEU  68           HB2      LEU  68  -5.854  -9.843  -5.127
  528    HG   LEU  68           HG       LEU  68  -4.555  -7.136  -5.568
  529   HD11  LEU  68          HD11      LEU  68  -6.703  -6.129  -5.163
  530   HD12  LEU  68          HD12      LEU  68  -7.456  -7.734  -4.817
  531   HD13  LEU  68          HD13      LEU  68  -6.886  -7.307  -6.465
  532   HD21  LEU  68          HD21      LEU  68  -4.041  -8.155  -3.435
  533   HD22  LEU  68          HD22      LEU  68  -5.747  -8.484  -3.113
  534   HD23  LEU  68          HD23      LEU  68  -5.187  -6.841  -3.195
  535    H    GLU  69           H        GLU  69  -3.204 -11.302  -7.600
  536    HA   GLU  69           HA       GLU  69  -4.550 -13.665  -6.922
  537    HB2  GLU  69           HB3      GLU  69  -3.159 -12.710  -9.129
  538    HB3  GLU  69           HB2      GLU  69  -2.125 -14.019  -8.518
  539    HG2  GLU  69           HG3      GLU  69  -4.022 -15.598  -8.638
  540    HG3  GLU  69           HG2      GLU  69  -5.083 -14.277  -9.165
  541    H    ASN  70           H        ASN  70  -0.990 -13.573  -7.264
  542    HA   ASN  70           HA       ASN  70  -0.847 -15.146  -4.748
  543    HB2  ASN  70           HB3      ASN  70   0.561 -15.423  -7.403
  544    HB3  ASN  70           HB2      ASN  70   1.381 -15.927  -5.861
  545   HD21  ASN  70          HD21      ASN  70  -0.964 -16.712  -8.240
  546   HD22  ASN  70          HD22      ASN  70  -1.499 -18.190  -7.513
  547    HA   PRO  71           HA       PRO  71   1.242 -11.159  -3.674
  548    HB2  PRO  71           HB3      PRO  71   1.215 -12.657  -1.094
  549    HB3  PRO  71           HB2      PRO  71   0.770 -10.964  -1.422
  550    HG2  PRO  71           HG3      PRO  71  -1.137 -12.770  -0.995
  551    HG3  PRO  71           HG2      PRO  71  -1.313 -11.505  -2.213
  552    HD2  PRO  71           HD3      PRO  71  -0.704 -14.413  -2.553
  553    HD3  PRO  71           HD2      PRO  71  -1.710 -13.347  -3.581
  554    H    LYS  72           H        LYS  72   2.126 -14.475  -2.935
  555    HA   LYS  72           HA       LYS  72   4.842 -13.820  -2.307
  556    HB2  LYS  72           HB3      LYS  72   4.818 -15.874  -1.391
  557    HB3  LYS  72           HB2      LYS  72   3.177 -16.033  -1.931
  558    HG2  LYS  72           HG3      LYS  72   4.157 -17.912  -2.831
  559    HG3  LYS  72           HG2      LYS  72   4.397 -16.754  -4.177
  560    HD2  LYS  72           HD3      LYS  72   6.594 -16.477  -2.347
  561    HD3  LYS  72           HD2      LYS  72   6.393 -18.177  -2.780
  562    HE2  LYS  72           HE3      LYS  72   6.070 -16.730  -5.169
  563    HE3  LYS  72           HE2      LYS  72   7.447 -16.017  -4.333
  564    HZ1  LYS  72           HZ1      LYS  72   8.408 -18.231  -4.173
  565    HZ2  LYS  72           HZ2      LYS  72   8.050 -17.845  -5.810
  566    HZ3  LYS  72           HZ3      LYS  72   7.047 -18.910  -4.916
  567    H    LYS  73           H        LYS  73   3.056 -14.579  -5.132
  568    HA   LYS  73           HA       LYS  73   5.245 -15.521  -6.727
  569    HB2  LYS  73           HB3      LYS  73   3.740 -15.578  -8.502
  570    HB3  LYS  73           HB2      LYS  73   2.630 -15.694  -7.091
  571    HG2  LYS  73           HG3      LYS  73   1.543 -14.111  -8.204
  572    HG3  LYS  73           HG2      LYS  73   2.696 -13.042  -7.441
  573    HD2  LYS  73           HD3      LYS  73   2.334 -12.718  -9.948
  574    HD3  LYS  73           HD2      LYS  73   4.052 -12.859  -9.377
  575    HE2  LYS  73           HE3      LYS  73   3.488 -14.220 -11.413
  576    HE3  LYS  73           HE2      LYS  73   4.238 -15.104 -10.083
  577    HZ1  LYS  73           HZ1      LYS  73   1.865 -15.726  -9.431
  578    HZ2  LYS  73           HZ2      LYS  73   2.470 -16.417 -10.827
  579    HZ3  LYS  73           HZ3      LYS  73   1.416 -15.118 -10.959
  580    H    TYR  74           H        TYR  74   3.968 -12.356  -5.924
  581    HA   TYR  74           HA       TYR  74   5.511 -11.012  -7.977
  582    HB2  TYR  74           HB3      TYR  74   3.571 -10.239  -5.880
  583    HB3  TYR  74           HB2      TYR  74   4.741  -9.013  -6.301
  584    HD1  TYR  74           HD1      TYR  74   2.286 -11.303  -7.844
  585    HD2  TYR  74           HD2      TYR  74   4.403  -7.633  -8.180
  586    HE1  TYR  74           HE1      TYR  74   0.896 -10.672  -9.818
  587    HE2  TYR  74           HE2      TYR  74   3.077  -7.003 -10.153
  588    HH   TYR  74           HH       TYR  74   0.854  -9.242 -11.644
  589    H    ILE  75           H        ILE  75   5.721 -11.423  -4.460
  590    HA   ILE  75           HA       ILE  75   8.549 -10.681  -4.639
  591    HB   ILE  75           HB       ILE  75   6.510  -9.684  -2.605
  592   HG12  ILE  75          HG13      ILE  75   6.586  -8.170  -4.370
  593   HG13  ILE  75          HG12      ILE  75   7.793  -7.524  -3.234
  594   HG21  ILE  75          HG21      ILE  75   8.525  -8.675  -1.487
  595   HG22  ILE  75          HG22      ILE  75   9.507  -9.781  -2.407
  596   HG23  ILE  75          HG23      ILE  75   8.336 -10.417  -1.273
  597   HD11  ILE  75          HD11      ILE  75   9.084  -7.400  -5.030
  598   HD12  ILE  75          HD12      ILE  75   8.136  -8.553  -5.920
  599   HD13  ILE  75          HD13      ILE  75   9.360  -9.118  -4.785
  600    HA   PRO  76           HA       PRO  76   8.023 -14.877  -2.688
  601    HB2  PRO  76           HB3      PRO  76  10.695 -15.110  -3.898
  602    HB3  PRO  76           HB2      PRO  76   9.343 -16.211  -3.966
  603    HG2  PRO  76           HG3      PRO  76  10.029 -14.703  -6.131
  604    HG3  PRO  76           HG2      PRO  76   8.354 -15.056  -5.727
  605    HD2  PRO  76           HD3      PRO  76   9.942 -12.594  -5.276
  606    HD3  PRO  76           HD2      PRO  76   8.231 -12.727  -5.810
  607    H    GLY  77           H        GLY  77   8.630 -15.319  -0.667
  608    HA2  GLY  77           HA3      GLY  77  10.370 -15.576   0.943
  609    HA3  GLY  77           HA2      GLY  77  11.150 -14.143   0.303
  610    H    THR  78           H        THR  78   8.293 -12.947   0.158
  611    HA   THR  78           HA       THR  78   8.383 -11.907   2.898
  612    HB   THR  78           HB       THR  78   8.212 -10.612   0.513
  613    HG1  THR  78           HG1      THR  78   7.262  -9.629   2.980
  614   HG21  THR  78          HG21      THR  78   5.771 -11.389   0.455
  615   HG22  THR  78          HG22      THR  78   6.120  -9.669   0.152
  616   HG23  THR  78          HG23      THR  78   5.515 -10.245   1.736
  617    H    LYS  79           H        LYS  79   6.855 -12.409   4.321
  618    HA   LYS  79           HA       LYS  79   4.445 -13.789   3.418
  619    HB2  LYS  79           HB3      LYS  79   6.182 -14.837   5.102
  620    HB3  LYS  79           HB2      LYS  79   5.354 -13.784   6.248
  621    HG2  LYS  79           HG3      LYS  79   4.560 -16.229   5.927
  622    HG3  LYS  79           HG2      LYS  79   3.360 -14.980   6.131
  623    HD2  LYS  79           HD3      LYS  79   2.862 -16.546   4.289
  624    HD3  LYS  79           HD2      LYS  79   2.986 -14.865   3.748
  625    HE2  LYS  79           HE3      LYS  79   4.115 -16.521   2.271
  626    HE3  LYS  79           HE2      LYS  79   5.180 -15.307   2.873
  627    HZ1  LYS  79           HZ1      LYS  79   6.103 -17.623   2.935
  628    HZ2  LYS  79           HZ2      LYS  79   4.879 -18.027   4.023
  629    HZ3  LYS  79           HZ3      LYS  79   6.047 -16.842   4.445
  630    H    MET  80           H        MET  80   2.443 -13.066   4.083
  631    HA   MET  80           HA       MET  80   2.442 -10.463   5.396
  632    HB2  MET  80           HB3      MET  80   1.334 -10.807   3.125
  633    HB3  MET  80           HB2      MET  80   0.115 -11.665   3.983
  634    HG2  MET  80           HG3      MET  80  -0.844  -9.599   3.933
  635    HG3  MET  80           HG2      MET  80   0.075  -9.471   5.425
  636    HE1  MET  80           HE1      MET  80   2.120  -9.562   2.133
  637    HE2  MET  80           HE2      MET  80   1.957  -7.939   1.545
  638    HE3  MET  80           HE3      MET  80   0.548  -9.012   1.552
  639    H    ILE  81           H        ILE  81   2.139 -10.507   7.101
  640    HA   ILE  81           HA       ILE  81   0.343 -12.563   8.598
  641    HB   ILE  81           HB       ILE  81   2.333 -10.660   9.942
  642   HG12  ILE  81          HG13      ILE  81   3.230 -13.148  10.449
  643   HG13  ILE  81          HG12      ILE  81   2.338 -13.499   9.009
  644   HG21  ILE  81          HG21      ILE  81   1.303 -12.943  11.517
  645   HG22  ILE  81          HG22      ILE  81   0.208 -11.575  11.293
  646   HG23  ILE  81          HG23      ILE  81   1.769 -11.286  12.019
  647   HD11  ILE  81          HD11      ILE  81   4.386 -13.074   8.100
  648   HD12  ILE  81          HD12      ILE  81   4.782 -11.834   9.335
  649   HD13  ILE  81          HD13      ILE  81   3.616 -11.452   8.071
  650    H    PHE  82           H        PHE  82  -1.636 -11.963   9.736
  651    HA   PHE  82           HA       PHE  82  -3.167 -10.623  10.869
  652    HB2  PHE  82           HB3      PHE  82  -1.050  -9.199  11.426
  653    HB3  PHE  82           HB2      PHE  82  -1.699  -8.113  10.138
  654    HD1  PHE  82           HD1      PHE  82  -2.303  -9.466  13.489
  655    HD2  PHE  82           HD2      PHE  82  -3.711  -6.860  10.506
  656    HE1  PHE  82           HE1      PHE  82  -3.848  -8.467  15.118
  657    HE2  PHE  82           HE2      PHE  82  -5.274  -5.784  12.062
  658    HZ   PHE  82           HZ       PHE  82  -5.317  -6.600  14.419
  659    H    ALA  83           H        ALA  83  -4.859  -8.979  10.278
  660    HA   ALA  83           HA       ALA  83  -5.390  -7.529   8.170
  661    HB1  ALA  83           HB1      ALA  83  -6.130  -9.331   6.386
  662    HB2  ALA  83           HB2      ALA  83  -4.813 -10.270   7.149
  663    HB3  ALA  83           HB3      ALA  83  -4.466  -8.717   6.433
  664    H    GLY  84           H        GLY  84  -7.057  -7.121   9.601
  665    HA2  GLY  84           HA3      GLY  84  -9.107  -9.070  10.148
  666    HA3  GLY  84           HA2      GLY  84  -9.111  -7.405  10.677
  667    H    ILE  85           H        ILE  85  -8.500  -7.844   7.344
  668    HA   ILE  85           HA       ILE  85 -11.306  -7.493   6.650
  669    HB   ILE  85           HB       ILE  85  -9.014  -5.894   5.561
  670   HG12  ILE  85          HG13      ILE  85 -10.538  -5.487   7.815
  671   HG13  ILE  85          HG12      ILE  85  -9.561  -4.287   6.973
  672   HG21  ILE  85          HG21      ILE  85 -11.936  -5.818   4.811
  673   HG22  ILE  85          HG22      ILE  85 -10.673  -6.489   3.795
  674   HG23  ILE  85          HG23      ILE  85 -10.690  -4.757   4.206
  675   HD11  ILE  85          HD11      ILE  85 -11.689  -3.950   5.534
  676   HD12  ILE  85          HD12      ILE  85 -11.596  -3.247   7.144
  677   HD13  ILE  85          HD13      ILE  85 -12.533  -4.721   6.894
  678    H    LYS  86           H        LYS  86 -11.945  -8.327   4.635
  679    HA   LYS  86           HA       LYS  86  -9.972  -9.588   2.919
  680    HB2  LYS  86           HB3      LYS  86 -11.619 -11.683   2.994
  681    HB3  LYS  86           HB2      LYS  86 -10.236 -11.496   4.123
  682    HG2  LYS  86           HG3      LYS  86 -12.499 -10.204   5.278
  683    HG3  LYS  86           HG2      LYS  86 -12.981 -11.801   4.715
  684    HD2  LYS  86           HD3      LYS  86 -11.545 -12.871   6.169
  685    HD3  LYS  86           HD2      LYS  86 -10.443 -11.497   6.294
  686    HE2  LYS  86           HE3      LYS  86 -12.533 -10.367   7.403
  687    HE3  LYS  86           HE2      LYS  86 -13.006 -12.063   7.720
  688    HZ1  LYS  86           HZ1      LYS  86 -10.317 -11.001   8.402
  689    HZ2  LYS  86           HZ2      LYS  86 -11.089 -12.370   8.993
  690    HZ3  LYS  86           HZ3      LYS  86 -11.590 -10.799   9.463
  691    H    LYS  87           H        LYS  87 -13.358  -8.909   3.630
  692    HA   LYS  87           HA       LYS  87 -14.702  -9.480   1.420
  693    HB2  LYS  87           HB3      LYS  87 -14.997  -7.587   3.449
  694    HB3  LYS  87           HB2      LYS  87 -15.196  -6.691   1.985
  695    HG2  LYS  87           HG3      LYS  87 -17.288  -7.404   1.885
  696    HG3  LYS  87           HG2      LYS  87 -16.682  -9.059   1.613
  697    HD2  LYS  87           HD3      LYS  87 -16.496  -9.160   4.158
  698    HD3  LYS  87           HD2      LYS  87 -17.451  -7.677   4.198
  699    HE2  LYS  87           HE3      LYS  87 -18.781  -9.779   4.454
  700    HE3  LYS  87           HE2      LYS  87 -19.296  -8.771   3.108
  701    HZ1  LYS  87           HZ1      LYS  87 -19.023 -11.300   2.735
  702    HZ2  LYS  87           HZ2      LYS  87 -17.379 -10.954   2.635
  703    HZ3  LYS  87           HZ3      LYS  87 -18.511 -10.219   1.548
  704    H    LYS  88           H        LYS  88 -14.269  -9.339  -0.672
  705    HA   LYS  88           HA       LYS  88 -12.196  -7.960  -1.853
  706    HB2  LYS  88           HB3      LYS  88 -13.366  -9.743  -3.032
  707    HB3  LYS  88           HB2      LYS  88 -14.854  -8.746  -3.080
  708    HG2  LYS  88           HG3      LYS  88 -13.835  -7.265  -4.662
  709    HG3  LYS  88           HG2      LYS  88 -12.226  -7.933  -4.393
  710    HD2  LYS  88           HD3      LYS  88 -14.450  -8.858  -6.101
  711    HD3  LYS  88           HD2      LYS  88 -12.747  -9.093  -6.293
  712    HE2  LYS  88           HE3      LYS  88 -13.688 -11.270  -5.892
  713    HE3  LYS  88           HE2      LYS  88 -12.765 -10.779  -4.467
  714    HZ1  LYS  88           HZ1      LYS  88 -15.409 -11.561  -4.586
  715    HZ2  LYS  88           HZ2      LYS  88 -15.452  -9.916  -4.224
  716    HZ3  LYS  88           HZ3      LYS  88 -14.593 -10.989  -3.228
  717    H    THR  89           H        THR  89 -15.509  -6.927  -1.267
  718    HA   THR  89           HA       THR  89 -15.372  -4.480  -2.755
  719    HB   THR  89           HB       THR  89 -17.468  -4.016  -1.963
  720    HG1  THR  89           HG1      THR  89 -17.346  -3.797   0.158
  721   HG21  THR  89          HG21      THR  89 -17.361  -6.975  -1.346
  722   HG22  THR  89          HG22      THR  89 -17.413  -6.297  -2.971
  723   HG23  THR  89          HG23      THR  89 -18.750  -6.007  -1.858
  724    H    GLU  90           H        GLU  90 -14.479  -5.407   0.531
  725    HA   GLU  90           HA       GLU  90 -14.259  -2.738   1.551
  726    HB2  GLU  90           HB3      GLU  90 -13.015  -5.276   2.571
  727    HB3  GLU  90           HB2      GLU  90 -13.205  -3.769   3.457
  728    HG2  GLU  90           HG3      GLU  90 -15.651  -4.940   2.383
  729    HG3  GLU  90           HG2      GLU  90 -14.897  -5.849   3.635
  730    H    ARG  91           H        ARG  91 -11.993  -5.182   0.363
  731    HA   ARG  91           HA       ARG  91  -9.599  -3.714   0.722
  732    HB2  ARG  91           HB3      ARG  91 -10.154  -5.911  -1.223
  733    HB3  ARG  91           HB2      ARG  91  -8.583  -5.103  -1.049
  734    HG2  ARG  91           HG3      ARG  91  -9.074  -5.754   1.531
  735    HG3  ARG  91           HG2      ARG  91  -9.841  -7.122   0.657
  736    HD2  ARG  91           HD3      ARG  91  -7.197  -6.925  -0.573
  737    HD3  ARG  91           HD2      ARG  91  -7.089  -6.646   1.163
  738    HE   ARG  91           HE       ARG  91  -8.427  -8.767   1.141
  739   HH11  ARG  91          HH11      ARG  91  -6.023  -7.812  -1.155
  740   HH12  ARG  91          HH12      ARG  91  -5.506  -9.431  -1.488
  741   HH21  ARG  91          HH21      ARG  91  -7.763 -10.943   0.723
  742   HH22  ARG  91          HH22      ARG  91  -6.523 -11.205  -0.453
  743    H    GLU  92           H        GLU  92 -11.626  -4.184  -2.184
  744    HA   GLU  92           HA       GLU  92 -10.173  -2.516  -3.887
  745    HB2  GLU  92           HB3      GLU  92 -12.032  -4.095  -4.539
  746    HB3  GLU  92           HB2      GLU  92 -13.143  -2.907  -3.990
  747    HG2  GLU  92           HG3      GLU  92 -12.964  -2.748  -6.387
  748    HG3  GLU  92           HG2      GLU  92 -12.221  -1.325  -5.641
  749    H    ASP  93           H        ASP  93 -12.739  -1.734  -1.652
  750    HA   ASP  93           HA       ASP  93 -13.191   0.904  -2.394
  751    HB2  ASP  93           HB3      ASP  93 -14.752  -0.063  -0.899
  752    HB3  ASP  93           HB2      ASP  93 -13.524  -0.513   0.244
  753    H    GLY  94           H        GLY  94 -10.949  -0.464  -0.002
  754    HA2  GLY  94           HA3      GLY  94  -9.877   1.977   0.938
  755    HA3  GLY  94           HA2      GLY  94  -9.046   0.439   0.957
  756    H    ILE  95           H        ILE  95  -9.081  -0.021  -1.896
  757    HA   ILE  95           HA       ILE  95  -6.675   1.225  -2.608
  758    HB   ILE  95           HB       ILE  95  -8.662  -0.444  -3.974
  759   HG12  ILE  95          HG13      ILE  95  -5.663  -0.434  -3.652
  760   HG13  ILE  95          HG12      ILE  95  -6.835  -1.534  -2.867
  761   HG21  ILE  95          HG21      ILE  95  -8.526   0.586  -5.975
  762   HG22  ILE  95          HG22      ILE  95  -6.844   0.062  -6.028
  763   HG23  ILE  95          HG23      ILE  95  -7.247   1.673  -5.361
  764   HD11  ILE  95          HD11      ILE  95  -6.511  -1.492  -5.816
  765   HD12  ILE  95          HD12      ILE  95  -7.250  -2.701  -4.797
  766   HD13  ILE  95          HD13      ILE  95  -5.482  -2.471  -4.798
  767    H    ALA  96           H        ALA  96 -10.025   2.079  -3.409
  768    HA   ALA  96           HA       ALA  96  -9.571   4.063  -5.296
  769    HB1  ALA  96           HB1      ALA  96 -11.807   3.187  -4.840
  770    HB2  ALA  96           HB2      ALA  96 -11.780   4.935  -4.602
  771    HB3  ALA  96           HB3      ALA  96 -11.767   3.854  -3.208
  772    H    TYR  97           H        TYR  97  -9.817   4.326  -1.766
  773    HA   TYR  97           HA       TYR  97  -9.388   7.068  -1.596
  774    HB2  TYR  97           HB3      TYR  97 -10.207   5.966   0.342
  775    HB3  TYR  97           HB2      TYR  97  -8.893   4.797   0.327
  776    HD1  TYR  97           HD1      TYR  97  -7.967   5.110   2.450
  777    HD2  TYR  97           HD2      TYR  97  -8.639   8.486  -0.033
  778    HE1  TYR  97           HE1      TYR  97  -6.697   6.530   4.057
  779    HE2  TYR  97           HE2      TYR  97  -7.374   9.889   1.553
  780    HH   TYR  97           HH       TYR  97  -5.582   8.561   4.168
  781    H    LEU  98           H        LEU  98  -7.210   4.326  -1.779
  782    HA   LEU  98           HA       LEU  98  -4.796   5.672  -1.174
  783    HB2  LEU  98           HB3      LEU  98  -5.616   3.073  -1.855
  784    HB3  LEU  98           HB2      LEU  98  -4.535   3.517  -3.147
  785    HG   LEU  98           HG       LEU  98  -3.734   3.760  -0.234
  786   HD11  LEU  98          HD11      LEU  98  -2.314   1.681  -1.340
  787   HD12  LEU  98          HD12      LEU  98  -3.898   1.421  -2.024
  788   HD13  LEU  98          HD13      LEU  98  -3.692   1.507  -0.254
  789   HD21  LEU  98          HD21      LEU  98  -2.279   3.934  -2.857
  790   HD22  LEU  98          HD22      LEU  98  -1.447   3.730  -1.325
  791   HD23  LEU  98          HD23      LEU  98  -2.409   5.199  -1.619
  792    H    LYS  99           H        LYS  99  -6.688   5.307  -4.149
  793    HA   LYS  99           HA       LYS  99  -4.787   6.124  -5.988
  794    HB2  LYS  99           HB3      LYS  99  -7.740   6.721  -6.192
  795    HB3  LYS  99           HB2      LYS  99  -6.582   6.508  -7.483
  796    HG2  LYS  99           HG3      LYS  99  -7.556   4.407  -5.595
  797    HG3  LYS  99           HG2      LYS  99  -7.995   4.541  -7.275
  798    HD2  LYS  99           HD3      LYS  99  -6.304   2.869  -6.607
  799    HD3  LYS  99           HD2      LYS  99  -5.396   4.450  -7.605
  800    HE2  LYS  99           HE3      LYS  99  -4.165   3.732  -5.908
  801    HE3  LYS  99           HE2      LYS  99  -5.625   3.902  -4.891
  802    HZ1  LYS  99           HZ1      LYS  99  -4.278   1.528  -5.631
  803    HZ2  LYS  99           HZ2      LYS  99  -5.834   1.451  -6.359
  804    HZ3  LYS  99           HZ3      LYS  99  -5.685   1.657  -4.710
  805    H    LYS 100           H        LYS 100  -7.074   7.994  -4.114
  806    HA   LYS 100           HA       LYS 100  -6.228  10.480  -5.215
  807    HB2  LYS 100           HB3      LYS 100  -8.281  10.949  -4.434
  808    HB3  LYS 100           HB2      LYS 100  -8.267   9.566  -3.396
  809    HG2  LYS 100           HG3      LYS 100  -6.929  10.861  -1.747
  810    HG3  LYS 100           HG2      LYS 100  -7.101  12.295  -2.783
  811    HD2  LYS 100           HD3      LYS 100  -9.334  10.771  -1.352
  812    HD3  LYS 100           HD2      LYS 100  -8.766  12.472  -1.116
  813    HE2  LYS 100           HE3      LYS 100  -9.867  11.463  -3.750
  814    HE3  LYS 100           HE2      LYS 100 -10.937  12.065  -2.459
  815    HZ1  LYS 100           HZ1      LYS 100  -9.476  13.524  -4.333
  816    HZ2  LYS 100           HZ2      LYS 100  -8.861  13.902  -2.804
  817    HZ3  LYS 100           HZ3      LYS 100 -10.506  14.120  -3.109
  818    H    ALA 101           H        ALA 101  -5.573   8.623  -2.342
  819    HA   ALA 101           HA       ALA 101  -4.177  10.467  -0.798
  820    HB1  ALA 101           HB1      ALA 101  -3.417   7.587  -0.859
  821    HB2  ALA 101           HB2      ALA 101  -4.999   8.081  -0.232
  822    HB3  ALA 101           HB3      ALA 101  -3.520   8.724   0.520
  823    H    THR 102           H        THR 102  -3.215   8.702  -3.627
  824    HA   THR 102           HA       THR 102  -0.436   9.561  -3.235
  825    HB   THR 102           HB       THR 102  -0.376   7.329  -3.839
  826    HG1  THR 102           HG1      THR 102  -0.861   8.032  -5.509
  827   HG21  THR 102          HG21      THR 102  -2.882   7.857  -5.203
  828   HG22  THR 102          HG22      THR 102  -2.300   6.364  -4.468
  829   HG23  THR 102          HG23      THR 102  -1.803   6.793  -6.105
  830    H    ASN 103           H        ASN 103  -3.368  10.066  -4.898
  831    HA   ASN 103           HA       ASN 103  -2.390  12.472  -6.092
  832    HB2  ASN 103           HB3      ASN 103  -3.798  10.755  -8.055
  833    HB3  ASN 103           HB2      ASN 103  -2.544  12.015  -8.313
  834   HD21  ASN 103          HD21      ASN 103  -3.127   8.668  -7.293
  835   HD22  ASN 103          HD22      ASN 103  -1.564   8.086  -7.608
  836    H    GLU 104           H        GLU 104  -3.839  13.787  -5.304
  837    HA   GLU 104           HA       GLU 104  -6.264  14.347  -6.208
  838    HB2  GLU 104           HB3      GLU 104  -6.436  11.971  -4.384
  839    HB3  GLU 104           HB2      GLU 104  -7.714  13.170  -4.287
  840    HG2  GLU 104           HG3      GLU 104  -7.066  12.428  -7.006
  841    HG3  GLU 104           HG2      GLU 104  -7.649  11.074  -6.053
  842    HHA  HEC 201           HHA      HEC 201   5.287  -5.280   0.516
  843    HHB  HEC 201           HHB      HEC 201  -0.293  -2.482   0.355
  844    HHC  HEC 201           HHC      HEC 201  -2.012  -6.230   5.150
  845    HHD  HEC 201           HHD      HEC 201   4.135  -6.076   6.810
  846   HMA1  HEC 201          HMA1      HEC 201   1.069  -1.171  -1.183
  847   HMA2  HEC 201          HMA2      HEC 201   2.682  -0.344  -0.673
  848   HMA3  HEC 201          HMA3      HEC 201   2.509  -1.615  -1.489
  849   HAA1  HEC 201          HAA1      HEC 201   5.139  -3.058  -1.394
  850   HAA2  HEC 201          HAA2      HEC 201   5.749  -2.487   0.152
  851   HBA1  HEC 201          HBA1      HEC 201   4.304  -0.387  -0.175
  852   HBA2  HEC 201          HBA2      HEC 201   4.036  -1.011  -1.839
  853   HMB1  HEC 201          HMB1      HEC 201  -3.507  -1.994   2.032
  854   HMB2  HEC 201          HMB2      HEC 201  -3.594  -3.241   0.825
  855   HMB3  HEC 201          HMB3      HEC 201  -2.317  -1.998   0.745
  856    HAB  HEC 201           HAB      HEC 201  -3.809  -3.372   4.511
  857   HBB1  HEC 201          HBB1      HEC 201  -5.257  -5.317   2.727
  858   HBB2  HEC 201          HBB2      HEC 201  -4.609  -3.823   2.017
  859   HBB3  HEC 201          HBB3      HEC 201  -5.723  -3.737   3.410
  860   HMC1  HEC 201          HMC1      HEC 201  -0.871  -7.740   8.482
  861   HMC2  HEC 201          HMC2      HEC 201  -1.861  -7.880   6.894
  862   HMC3  HEC 201          HMC3      HEC 201  -0.518  -8.506   7.204
  863    HAC  HEC 201           HAC      HEC 201   3.054  -7.063   8.272
  864   HBC1  HEC 201          HBC1      HEC 201   3.327  -9.451   7.715
  865   HBC2  HEC 201          HBC2      HEC 201   1.675  -9.760   8.287
  866   HBC3  HEC 201          HBC3      HEC 201   2.928  -9.210   9.434
  867   HMD1  HEC 201          HMD1      HEC 201   6.056  -7.271   6.369
  868   HMD2  HEC 201          HMD2      HEC 201   7.244  -5.984   5.997
  869   HMD3  HEC 201          HMD3      HEC 201   7.335  -7.511   5.135
  870   HAD1  HEC 201          HAD1      HEC 201   8.024  -6.502   3.204
  871   HAD2  HEC 201          HAD2      HEC 201   7.634  -5.071   2.215
  872   HBD1  HEC 201          HBD1      HEC 201   7.932  -7.696   1.299
  873   HBD2  HEC 201          HBD2      HEC 201   7.402  -6.311   0.390
  Start of MODEL   10
    1    H1   GLY   1          1H        GLY   1 -19.223   4.199  -0.466
    2    H2   GLY   1          2H        GLY   1 -18.577   3.660  -1.967
    3    H3   GLY   1          3H        GLY   1 -18.771   5.316  -1.640
    4    HA2  GLY   1           HA2      GLY   1 -17.134   3.914   0.267
    5    HA3  GLY   1           HA3      GLY   1 -16.469   3.884  -1.331
    6    H    ASP   2           H        ASP   2 -16.404   5.423   1.513
    7    HA   ASP   2           HA       ASP   2 -15.760   8.016   0.227
    8    HB2  ASP   2           HB3      ASP   2 -16.447   7.605   3.245
    9    HB3  ASP   2           HB2      ASP   2 -16.429   9.128   2.179
   10    H    VAL   3           H        VAL   3 -14.030   9.226   1.150
   11    HA   VAL   3           HA       VAL   3 -11.652   7.715   1.444
   12    HB   VAL   3           HB       VAL   3 -12.329  10.601   1.617
   13   HG11  VAL   3          HG11      VAL   3 -11.020  10.635   3.532
   14   HG12  VAL   3          HG12      VAL   3  -9.853  10.954   2.282
   15   HG13  VAL   3          HG13      VAL   3  -9.964   9.337   2.978
   16   HG21  VAL   3          HG21      VAL   3 -11.554  10.352  -0.462
   17   HG22  VAL   3          HG22      VAL   3 -10.876   8.772  -0.070
   18   HG23  VAL   3          HG23      VAL   3  -9.953  10.244   0.292
   19    H    GLU   4           H        GLU   4 -13.755   9.446   3.787
   20    HA   GLU   4           HA       GLU   4 -12.128   9.056   6.122
   21    HB2  GLU   4           HB3      GLU   4 -14.038  10.547   6.198
   22    HB3  GLU   4           HB2      GLU   4 -15.111   9.170   5.904
   23    HG2  GLU   4           HG3      GLU   4 -14.274   8.244   8.079
   24    HG3  GLU   4           HG2      GLU   4 -13.572   9.875   8.369
   25    H    LYS   5           H        LYS   5 -14.636   6.956   4.854
   26    HA   LYS   5           HA       LYS   5 -14.527   4.982   6.870
   27    HB2  LYS   5           HB3      LYS   5 -15.359   4.638   3.977
   28    HB3  LYS   5           HB2      LYS   5 -15.761   3.632   5.349
   29    HG2  LYS   5           HG3      LYS   5 -16.643   6.037   6.171
   30    HG3  LYS   5           HG2      LYS   5 -17.008   6.047   4.422
   31    HD2  LYS   5           HD3      LYS   5 -17.677   3.523   5.758
   32    HD3  LYS   5           HD2      LYS   5 -18.600   4.959   6.316
   33    HE2  LYS   5           HE3      LYS   5 -19.858   4.797   4.472
   34    HE3  LYS   5           HE2      LYS   5 -18.451   5.078   3.487
   35    HZ1  LYS   5           HZ1      LYS   5 -20.001   2.706   3.803
   36    HZ2  LYS   5           HZ2      LYS   5 -18.428   2.401   4.319
   37    HZ3  LYS   5           HZ3      LYS   5 -18.677   2.987   2.751
   38    H    GLY   6           H        GLY   6 -12.817   5.401   3.787
   39    HA2  GLY   6           HA3      GLY   6 -11.565   2.867   3.726
   40    HA3  GLY   6           HA2      GLY   6 -10.984   4.326   2.940
   41    H    LYS   7           H        LYS   7 -10.516   5.924   5.096
   42    HA   LYS   7           HA       LYS   7  -7.940   5.208   5.781
   43    HB2  LYS   7           HB3      LYS   7  -8.304   7.441   6.019
   44    HB3  LYS   7           HB2      LYS   7  -9.835   7.172   6.881
   45    HG2  LYS   7           HG3      LYS   7  -7.722   6.129   8.429
   46    HG3  LYS   7           HG2      LYS   7  -7.320   7.777   8.012
   47    HD2  LYS   7           HD3      LYS   7 -10.029   7.859   8.695
   48    HD3  LYS   7           HD2      LYS   7  -9.271   6.729   9.889
   49    HE2  LYS   7           HE3      LYS   7  -8.793   8.634  10.977
   50    HE3  LYS   7           HE2      LYS   7  -7.436   8.769   9.800
   51    HZ1  LYS   7           HZ1      LYS   7  -8.350  10.773   9.473
   52    HZ2  LYS   7           HZ2      LYS   7  -9.906  10.282   9.969
   53    HZ3  LYS   7           HZ3      LYS   7  -9.360   9.953   8.406
   54    H    LYS   8           H        LYS   8 -10.969   4.886   7.696
   55    HA   LYS   8           HA       LYS   8  -9.811   3.837  10.015
   56    HB2  LYS   8           HB3      LYS   8 -11.913   4.630  10.386
   57    HB3  LYS   8           HB2      LYS   8 -12.538   3.967   8.882
   58    HG2  LYS   8           HG3      LYS   8 -11.675   2.132  11.057
   59    HG3  LYS   8           HG2      LYS   8 -13.257   2.947  11.177
   60    HD2  LYS   8           HD3      LYS   8 -12.388   1.249   8.841
   61    HD3  LYS   8           HD2      LYS   8 -13.445   0.752  10.139
   62    HE2  LYS   8           HE3      LYS   8 -13.958   3.071   8.263
   63    HE3  LYS   8           HE2      LYS   8 -14.642   1.461   8.103
   64    HZ1  LYS   8           HZ1      LYS   8 -15.219   3.557  10.102
   65    HZ2  LYS   8           HZ2      LYS   8 -15.460   1.939  10.552
   66    HZ3  LYS   8           HZ3      LYS   8 -16.315   2.584   9.257
   67    H    ILE   9           H        ILE   9 -11.113   2.316   7.117
   68    HA   ILE   9           HA       ILE   9 -11.049  -0.359   8.033
   69    HB   ILE   9           HB       ILE   9 -11.165   0.985   5.360
   70   HG12  ILE   9          HG13      ILE   9 -12.703  -1.289   6.622
   71   HG13  ILE   9          HG12      ILE   9 -13.180   0.392   6.646
   72   HG21  ILE   9          HG21      ILE   9  -9.716  -0.455   4.465
   73   HG22  ILE   9          HG22      ILE   9 -11.088  -1.590   4.542
   74   HG23  ILE   9          HG23      ILE   9  -9.881  -1.591   5.840
   75   HD11  ILE   9          HD11      ILE   9 -13.544  -1.655   4.624
   76   HD12  ILE   9          HD12      ILE   9 -12.799  -0.174   3.991
   77   HD13  ILE   9          HD13      ILE   9 -14.315  -0.045   4.797
   78    H    PHE  10           H        PHE  10  -8.672   1.582   6.289
   79    HA   PHE  10           HA       PHE  10  -6.722  -0.429   6.061
   80    HB2  PHE  10           HB3      PHE  10  -6.311   1.351   4.590
   81    HB3  PHE  10           HB2      PHE  10  -6.682   2.548   5.829
   82    HD1  PHE  10           HD1      PHE  10  -4.146   0.772   4.079
   83    HD2  PHE  10           HD2      PHE  10  -5.026   2.864   7.707
   84    HE1  PHE  10           HE1      PHE  10  -1.708   1.086   4.531
   85    HE2  PHE  10           HE2      PHE  10  -2.626   3.149   8.111
   86    HZ   PHE  10           HZ       PHE  10  -0.977   2.268   6.506
   87    H    VAL  11           H        VAL  11  -7.394   2.023   8.385
   88    HA   VAL  11           HA       VAL  11  -4.919   2.029   9.556
   89    HB   VAL  11           HB       VAL  11  -7.654   2.506  10.813
   90   HG11  VAL  11          HG11      VAL  11  -6.640   3.353  12.734
   91   HG12  VAL  11          HG12      VAL  11  -5.015   3.425  11.954
   92   HG13  VAL  11          HG13      VAL  11  -5.749   1.875  12.389
   93   HG21  VAL  11          HG21      VAL  11  -7.534   4.467   9.695
   94   HG22  VAL  11          HG22      VAL  11  -5.962   4.002   9.024
   95   HG23  VAL  11          HG23      VAL  11  -6.039   4.846  10.621
   96    H    GLN  12           H        GLN  12  -7.789   0.017  10.569
   97    HA   GLN  12           HA       GLN  12  -6.087  -1.418  12.517
   98    HB2  GLN  12           HB3      GLN  12  -8.227  -2.786  12.861
   99    HB3  GLN  12           HB2      GLN  12  -8.316  -1.100  13.260
  100    HG2  GLN  12           HG3      GLN  12 -10.151  -0.973  11.986
  101    HG3  GLN  12           HG2      GLN  12  -9.053  -1.148  10.623
  102   HE21  GLN  12          HE21      GLN  12  -8.304  -3.841  11.272
  103   HE22  GLN  12          HE22      GLN  12  -9.703  -4.886  10.855
  104    H    LYS  13           H        LYS  13  -7.847  -1.946   9.699
  105    HA   LYS  13           HA       LYS  13  -7.687  -4.239   8.542
  106    HB2  LYS  13           HB3      LYS  13  -8.013  -2.471   7.149
  107    HB3  LYS  13           HB2      LYS  13  -6.696  -1.562   7.596
  108    HG2  LYS  13           HG3      LYS  13  -6.221  -2.222   5.451
  109    HG3  LYS  13           HG2      LYS  13  -5.376  -3.410   6.460
  110    HD2  LYS  13           HD3      LYS  13  -6.515  -5.123   5.546
  111    HD3  LYS  13           HD2      LYS  13  -8.050  -4.356   5.956
  112    HE2  LYS  13           HE3      LYS  13  -7.361  -3.086   3.369
  113    HE3  LYS  13           HE2      LYS  13  -6.845  -4.694   3.400
  114    HZ1  LYS  13           HZ1      LYS  13  -9.378  -3.971   4.319
  115    HZ2  LYS  13           HZ2      LYS  13  -8.817  -5.335   3.478
  116    HZ3  LYS  13           HZ3      LYS  13  -8.976  -3.839   2.706
  117    H    CYS  14           H        CYS  14  -4.640  -2.237   8.932
  118    HA   CYS  14           HA       CYS  14  -2.982  -4.371   9.580
  119    HB2  CYS  14           HB3      CYS  14  -1.601  -4.798   7.678
  120    HB3  CYS  14           HB2      CYS  14  -3.273  -5.464   7.524
  121    H    ALA  15           H        ALA  15  -3.584  -1.285   9.497
  122    HA   ALA  15           HA       ALA  15  -1.367   0.101   8.597
  123    HB1  ALA  15           HB1      ALA  15  -2.773   0.835  11.144
  124    HB2  ALA  15           HB2      ALA  15  -3.551   1.000   9.570
  125    HB3  ALA  15           HB3      ALA  15  -2.075   1.897   9.921
  126    H    GLN  16           H        GLN  16  -1.518  -2.096  11.555
  127    HA   GLN  16           HA       GLN  16   0.702  -1.132  12.905
  128    HB2  GLN  16           HB3      GLN  16   0.422  -4.088  12.937
  129    HB3  GLN  16           HB2      GLN  16   0.490  -2.932  14.298
  130    HG2  GLN  16           HG3      GLN  16  -1.928  -2.259  13.604
  131    HG3  GLN  16           HG2      GLN  16  -1.929  -3.702  12.590
  132   HE21  GLN  16          HE21      GLN  16  -0.780  -2.947  15.842
  133   HE22  GLN  16          HE22      GLN  16  -1.588  -4.267  16.641
  134    H    CYS  17           H        CYS  17   0.534  -3.320  10.212
  135    HA   CYS  17           HA       CYS  17   3.325  -3.999  10.197
  136    HB2  CYS  17           HB3      CYS  17   1.507  -4.280   7.837
  137    HB3  CYS  17           HB2      CYS  17   2.855  -5.299   8.305
  138    H    HIS  18           H        HIS  18   1.393  -1.401   9.022
  139    HA   HIS  18           HA       HIS  18   3.649  -0.513   7.290
  140    HB2  HIS  18           HB3      HIS  18   0.722   0.347   7.184
  141    HB3  HIS  18           HB2      HIS  18   2.023   0.840   6.111
  142    HD1  HIS  18           HD1      HIS  18   1.764  -0.264   3.931
  143    HD2  HIS  18           HD2      HIS  18   0.772  -2.761   7.136
  144    HE1  HIS  18           HE1      HIS  18   1.122  -2.492   2.880
  145    H    THR  19           H        THR  19   3.131  -0.195  10.284
  146    HA   THR  19           HA       THR  19   3.291   1.355  11.905
  147    HB   THR  19           HB       THR  19   4.785   2.925   9.779
  148    HG1  THR  19           HG1      THR  19   6.582   1.762  10.545
  149   HG21  THR  19          HG21      THR  19   5.204   2.977  12.738
  150   HG22  THR  19          HG22      THR  19   4.264   4.170  11.818
  151   HG23  THR  19          HG23      THR  19   5.985   3.952  11.506
  152    H    VAL  20           H        VAL  20   2.641   3.509  12.673
  153    HA   VAL  20           HA       VAL  20   0.218   4.415  11.320
  154    HB   VAL  20           HB       VAL  20   1.348   5.713  13.766
  155   HG11  VAL  20          HG11      VAL  20  -0.815   6.367  12.440
  156   HG12  VAL  20          HG12      VAL  20  -0.873   6.318  14.214
  157   HG13  VAL  20          HG13      VAL  20  -1.543   4.972  13.238
  158   HG21  VAL  20          HG21      VAL  20   0.313   3.981  15.131
  159   HG22  VAL  20          HG22      VAL  20   1.520   3.235  14.103
  160   HG23  VAL  20          HG23      VAL  20  -0.192   3.091  13.694
  161    H    GLU  21           H        GLU  21   0.792   7.091  12.677
  162    HA   GLU  21           HA       GLU  21   1.501   8.486  10.332
  163    HB2  GLU  21           HB3      GLU  21   1.865  10.091  12.733
  164    HB3  GLU  21           HB2      GLU  21   0.708  10.274  11.409
  165    HG2  GLU  21           HG3      GLU  21  -0.756   8.620  12.477
  166    HG3  GLU  21           HG2      GLU  21   0.432   8.432  13.769
  167    H    LYS  22           H        LYS  22   3.385   9.605   9.796
  168    HA   LYS  22           HA       LYS  22   5.866   8.476  10.317
  169    HB2  LYS  22           HB3      LYS  22   5.168  10.149   8.504
  170    HB3  LYS  22           HB2      LYS  22   5.585  11.377   9.636
  171    HG2  LYS  22           HG3      LYS  22   7.403   9.322   8.477
  172    HG3  LYS  22           HG2      LYS  22   7.494  11.015   8.255
  173    HD2  LYS  22           HD3      LYS  22   7.986   9.540  10.807
  174    HD3  LYS  22           HD2      LYS  22   9.179  10.321   9.796
  175    HE2  LYS  22           HE3      LYS  22   8.278  12.472  10.268
  176    HE3  LYS  22           HE2      LYS  22   6.909  11.782  11.138
  177    HZ1  LYS  22           HZ1      LYS  22   9.398  12.529  12.175
  178    HZ2  LYS  22           HZ2      LYS  22   9.226  10.843  12.285
  179    HZ3  LYS  22           HZ3      LYS  22   8.068  11.822  13.005
  180    H    GLY  23           H        GLY  23   7.050   8.398  12.084
  181    HA2  GLY  23           HA3      GLY  23   8.196  10.218  13.553
  182    HA3  GLY  23           HA2      GLY  23   6.573  10.305  14.231
  183    H    GLY  24           H        GLY  24   6.133   7.443  13.827
  184    HA2  GLY  24           HA3      GLY  24   7.259   6.533  16.301
  185    HA3  GLY  24           HA2      GLY  24   6.180   5.604  15.255
  186    H    LYS  25           H        LYS  25   7.079   3.727  14.775
  187    HA   LYS  25           HA       LYS  25   9.943   3.744  14.085
  188    HB2  LYS  25           HB3      LYS  25   8.793   1.115  14.513
  189    HB3  LYS  25           HB2      LYS  25  10.211   1.812  15.237
  190    HG2  LYS  25           HG3      LYS  25   9.070   2.546  17.057
  191    HG3  LYS  25           HG2      LYS  25   7.537   2.773  16.163
  192    HD2  LYS  25           HD3      LYS  25   8.764   0.165  17.053
  193    HD3  LYS  25           HD2      LYS  25   7.317   0.938  17.739
  194    HE2  LYS  25           HE3      LYS  25   6.031  -0.010  16.270
  195    HE3  LYS  25           HE2      LYS  25   6.970   0.712  14.963
  196    HZ1  LYS  25           HZ1      LYS  25   6.951  -2.009  15.940
  197    HZ2  LYS  25           HZ2      LYS  25   8.535  -1.340  15.764
  198    HZ3  LYS  25           HZ3      LYS  25   7.447  -1.368  14.424
  199    H    HIS  26           H        HIS  26  10.620   2.326  12.323
  200    HA   HIS  26           HA       HIS  26   9.049   2.636  10.049
  201    HB2  HIS  26           HB3      HIS  26  10.948   0.549   9.628
  202    HB3  HIS  26           HB2      HIS  26  11.003   2.170   9.058
  203    HD1  HIS  26           HD1      HIS  26  11.730   0.489  12.385
  204    HD2  HIS  26           HD2      HIS  26  13.268   3.397   9.900
  205    HE1  HIS  26           HE1      HIS  26  13.786   1.262  13.531
  206    HE2  HIS  26           HE2      HIS  26  14.673   3.118  12.053
  207    H    LYS  27           H        LYS  27   7.782   1.255   8.879
  208    HA   LYS  27           HA       LYS  27   6.720  -0.987  10.371
  209    HB2  LYS  27           HB3      LYS  27   4.843  -0.869   8.984
  210    HB3  LYS  27           HB2      LYS  27   5.416   0.793   8.926
  211    HG2  LYS  27           HG3      LYS  27   6.799  -0.481   6.892
  212    HG3  LYS  27           HG2      LYS  27   5.184  -1.170   6.831
  213    HD2  LYS  27           HD3      LYS  27   5.663   1.025   5.488
  214    HD3  LYS  27           HD2      LYS  27   4.177   0.907   6.479
  215    HE2  LYS  27           HE3      LYS  27   4.816   2.653   7.743
  216    HE3  LYS  27           HE2      LYS  27   6.398   1.897   8.008
  217    HZ1  LYS  27           HZ1      LYS  27   7.210   2.916   6.055
  218    HZ2  LYS  27           HZ2      LYS  27   6.371   4.109   6.866
  219    HZ3  LYS  27           HZ3      LYS  27   5.696   3.383   5.521
  220    H    THR  28           H        THR  28   6.080  -2.978   8.988
  221    HA   THR  28           HA       THR  28   8.509  -4.196   8.151
  222    HB   THR  28           HB       THR  28   5.919  -5.375   7.355
  223    HG1  THR  28           HG1      THR  28   6.709  -5.480  10.066
  224   HG21  THR  28          HG21      THR  28   6.839  -7.448   7.935
  225   HG22  THR  28          HG22      THR  28   7.999  -6.678   9.012
  226   HG23  THR  28          HG23      THR  28   8.216  -6.562   7.281
  227    H    GLY  29           H        GLY  29   5.762  -2.851   6.389
  228    HA2  GLY  29           HA3      GLY  29   7.424  -2.943   3.950
  229    HA3  GLY  29           HA2      GLY  29   5.724  -3.482   3.917
  230    HA   PRO  30           HA       PRO  30   6.642   1.296   3.279
  231    HB2  PRO  30           HB3      PRO  30   5.566   0.372   0.590
  232    HB3  PRO  30           HB2      PRO  30   6.693   1.705   0.909
  233    HG2  PRO  30           HG3      PRO  30   7.591  -0.614   0.025
  234    HG3  PRO  30           HG2      PRO  30   8.484   0.270   1.266
  235    HD2  PRO  30           HD3      PRO  30   6.898  -2.248   1.610
  236    HD3  PRO  30           HD2      PRO  30   8.295  -1.655   2.504
  237    H    ASN  31           H        ASN  31   4.993   2.332   4.124
  238    HA   ASN  31           HA       ASN  31   2.430   1.366   4.523
  239    HB2  ASN  31           HB3      ASN  31   3.728   3.461   5.531
  240    HB3  ASN  31           HB2      ASN  31   2.792   4.341   4.294
  241   HD21  ASN  31          HD21      ASN  31   2.064   5.201   6.518
  242   HD22  ASN  31          HD22      ASN  31   0.653   4.495   7.174
  243    H    LEU  32           H        LEU  32   3.359   3.965   2.232
  244    HA   LEU  32           HA       LEU  32   1.873   2.918   0.169
  245    HB2  LEU  32           HB3      LEU  32  -0.024   4.427  -0.094
  246    HB3  LEU  32           HB2      LEU  32  -0.060   3.467   1.375
  247    HG   LEU  32           HG       LEU  32  -1.110   5.596   1.938
  248   HD11  LEU  32          HD11      LEU  32   1.554   5.224   2.879
  249   HD12  LEU  32          HD12      LEU  32   0.127   4.543   3.658
  250   HD13  LEU  32          HD13      LEU  32   0.394   6.285   3.679
  251   HD21  LEU  32          HD21      LEU  32  -0.337   7.558   1.176
  252   HD22  LEU  32          HD22      LEU  32   0.333   6.482  -0.050
  253   HD23  LEU  32          HD23      LEU  32   1.324   7.000   1.320
  254    H    HIS  33           H        HIS  33   3.379   5.650   1.722
  255    HA   HIS  33           HA       HIS  33   3.486   7.617  -0.195
  256    HB2  HIS  33           HB3      HIS  33   4.741   7.084   2.212
  257    HB3  HIS  33           HB2      HIS  33   6.079   7.280   1.021
  258    HD1  HIS  33           HD1      HIS  33   6.724   9.540   2.242
  259    HD2  HIS  33           HD2      HIS  33   2.920   9.486   0.480
  260    HE1  HIS  33           HE1      HIS  33   5.977  11.953   2.146
  261    HE2  HIS  33           HE2      HIS  33   3.653  11.874   1.151
  262    H    GLY  34           H        GLY  34   4.252   7.715  -2.204
  263    HA2  GLY  34           HA3      GLY  34   5.536   7.361  -4.082
  264    HA3  GLY  34           HA2      GLY  34   6.686   6.544  -3.001
  265    H    LEU  35           H        LEU  35   3.520   5.345  -2.834
  266    HA   LEU  35           HA       LEU  35   4.244   2.753  -3.630
  267    HB2  LEU  35           HB3      LEU  35   2.296   3.330  -2.223
  268    HB3  LEU  35           HB2      LEU  35   1.466   3.943  -3.610
  269    HG   LEU  35           HG       LEU  35   1.393   1.731  -4.605
  270   HD11  LEU  35          HD11      LEU  35   2.535  -0.102  -3.896
  271   HD12  LEU  35          HD12      LEU  35   2.372   0.383  -2.184
  272   HD13  LEU  35          HD13      LEU  35   3.584   1.187  -3.194
  273   HD21  LEU  35          HD21      LEU  35   0.335   2.105  -1.822
  274   HD22  LEU  35          HD22      LEU  35   0.072   0.578  -2.725
  275   HD23  LEU  35          HD23      LEU  35  -0.532   2.110  -3.355
  276    H    PHE  36           H        PHE  36   2.427   5.297  -5.374
  277    HA   PHE  36           HA       PHE  36   2.804   3.769  -7.880
  278    HB2  PHE  36           HB3      PHE  36   0.904   6.066  -7.809
  279    HB3  PHE  36           HB2      PHE  36   0.774   4.562  -8.652
  280    HD1  PHE  36           HD1      PHE  36  -0.294   2.611  -7.736
  281    HD2  PHE  36           HD2      PHE  36   0.253   6.211  -5.414
  282    HE1  PHE  36           HE1      PHE  36  -1.819   1.765  -5.992
  283    HE2  PHE  36           HE2      PHE  36  -1.299   5.376  -3.735
  284    HZ   PHE  36           HZ       PHE  36  -2.350   3.166  -4.017
  285    H    GLY  37           H        GLY  37   4.532   5.811  -6.361
  286    HA2  GLY  37           HA3      GLY  37   5.085   7.502  -8.692
  287    HA3  GLY  37           HA2      GLY  37   5.232   8.134  -7.079
  288    H    ARG  38           H        ARG  38   6.445   5.839  -5.889
  289    HA   ARG  38           HA       ARG  38   9.154   6.284  -6.849
  290    HB2  ARG  38           HB3      ARG  38   8.063   4.886  -4.404
  291    HB3  ARG  38           HB2      ARG  38   9.777   4.983  -4.788
  292    HG2  ARG  38           HG3      ARG  38   9.461   7.508  -4.823
  293    HG3  ARG  38           HG2      ARG  38   7.903   7.205  -4.054
  294    HD2  ARG  38           HD3      ARG  38   8.874   6.929  -2.073
  295    HD3  ARG  38           HD2      ARG  38   9.961   5.707  -2.728
  296    HE   ARG  38           HE       ARG  38  11.574   7.285  -2.440
  297   HH11  ARG  38          HH11      ARG  38   8.661   8.877  -3.487
  298   HH12  ARG  38          HH12      ARG  38   9.396  10.443  -3.582
  299   HH21  ARG  38          HH21      ARG  38  12.553   9.341  -2.560
  300   HH22  ARG  38          HH22      ARG  38  11.609  10.706  -3.055
  301    H    LYS  39           H        LYS  39  10.659   4.339  -6.866
  302    HA   LYS  39           HA       LYS  39   9.939   2.581  -8.876
  303    HB2  LYS  39           HB3      LYS  39  12.248   3.015  -8.220
  304    HB3  LYS  39           HB2      LYS  39  12.053   2.131  -6.716
  305    HG2  LYS  39           HG3      LYS  39  13.008   1.112  -9.040
  306    HG3  LYS  39           HG2      LYS  39  12.317   0.115  -7.790
  307    HD2  LYS  39           HD3      LYS  39  11.327  -0.487  -9.951
  308    HD3  LYS  39           HD2      LYS  39  10.107   0.233  -8.909
  309    HE2  LYS  39           HE3      LYS  39  10.715   2.477 -10.027
  310    HE3  LYS  39           HE2      LYS  39  11.521   1.428 -11.247
  311    HZ1  LYS  39           HZ1      LYS  39   9.519   0.660 -12.005
  312    HZ2  LYS  39           HZ2      LYS  39   8.999   2.157 -11.451
  313    HZ3  LYS  39           HZ3      LYS  39   8.750   0.725 -10.510
  314    H    THR  40           H        THR  40  11.002   0.941  -5.971
  315    HA   THR  40           HA       THR  40   8.430   0.016  -5.213
  316    HB   THR  40           HB       THR  40   8.929  -2.252  -4.986
  317    HG1  THR  40           HG1      THR  40  10.409  -3.447  -5.890
  318   HG21  THR  40          HG21      THR  40   8.607  -2.010  -7.737
  319   HG22  THR  40          HG22      THR  40   8.893  -2.847  -6.526
  320   HG23  THR  40          HG23      THR  40   7.502  -2.865  -6.223
  321    H    GLY  41           H        GLY  41   8.363   0.442  -3.429
  322    HA2  GLY  41           HA3      GLY  41   8.809   0.436  -1.199
  323    HA3  GLY  41           HA2      GLY  41   9.489  -1.188  -1.451
  324    H    GLN  42           H        GLN  42  10.761   1.855  -2.784
  325    HA   GLN  42           HA       GLN  42  13.250   1.317  -1.441
  326    HB2  GLN  42           HB3      GLN  42  13.792   3.362  -3.186
  327    HB3  GLN  42           HB2      GLN  42  14.009   1.673  -3.554
  328    HG2  GLN  42           HG3      GLN  42  12.782   2.839  -5.343
  329    HG3  GLN  42           HG2      GLN  42  11.878   1.523  -4.637
  330   HE21  GLN  42          HE21      GLN  42   9.846   2.035  -4.655
  331   HE22  GLN  42          HE22      GLN  42   9.130   3.505  -4.131
  332    H    ALA  43           H        ALA  43  11.341   2.328   0.198
  333    HA   ALA  43           HA       ALA  43  11.128   5.128   0.408
  334    HB1  ALA  43           HB1      ALA  43  11.240   4.222   3.044
  335    HB2  ALA  43           HB2      ALA  43  10.708   2.795   2.153
  336    HB3  ALA  43           HB3      ALA  43   9.811   4.332   2.034
  337    HA   PRO  44           HA       PRO  44  14.964   6.548   2.021
  338    HB2  PRO  44           HB3      PRO  44  14.364   8.199   4.031
  339    HB3  PRO  44           HB2      PRO  44  13.848   8.581   2.354
  340    HG2  PRO  44           HG3      PRO  44  12.248   7.394   4.591
  341    HG3  PRO  44           HG2      PRO  44  11.801   8.607   3.396
  342    HD2  PRO  44           HD3      PRO  44  11.149   5.958   3.264
  343    HD3  PRO  44           HD2      PRO  44  11.252   7.073   1.810
  344    H    GLY  45           H        GLY  45  14.079   7.091   5.212
  345    HA2  GLY  45           HA3      GLY  45  16.086   5.323   6.277
  346    HA3  GLY  45           HA2      GLY  45  14.925   6.291   7.248
  347    H    PHE  46           H        PHE  46  13.265   4.459   4.993
  348    HA   PHE  46           HA       PHE  46  12.333   2.669   7.082
  349    HB2  PHE  46           HB3      PHE  46  10.734   3.701   5.539
  350    HB3  PHE  46           HB2      PHE  46  11.541   2.941   4.150
  351    HD1  PHE  46           HD1      PHE  46   9.680   2.186   7.279
  352    HD2  PHE  46           HD2      PHE  46  10.891   0.779   3.465
  353    HE1  PHE  46           HE1      PHE  46   8.252   0.215   7.545
  354    HE2  PHE  46           HE2      PHE  46   9.412  -1.155   3.735
  355    HZ   PHE  46           HZ       PHE  46   8.112  -1.479   5.778
  356    H    THR  47           H        THR  47  12.759   0.537   7.282
  357    HA   THR  47           HA       THR  47  14.920  -0.548   5.715
  358    HB   THR  47           HB       THR  47  13.972  -0.905   8.297
  359    HG1  THR  47           HG1      THR  47  15.685  -2.473   8.376
  360   HG21  THR  47          HG21      THR  47  13.630  -3.385   8.395
  361   HG22  THR  47          HG22      THR  47  13.385  -3.401   6.667
  362   HG23  THR  47          HG23      THR  47  12.270  -2.510   7.740
  363    H    TYR  48           H        TYR  48  14.399  -1.063   3.677
  364    HA   TYR  48           HA       TYR  48  11.892  -2.194   2.919
  365    HB2  TYR  48           HB3      TYR  48  13.834  -2.679   0.903
  366    HB3  TYR  48           HB2      TYR  48  12.569  -1.457   0.922
  367    HD1  TYR  48           HD1      TYR  48  15.996  -2.061   2.283
  368    HD2  TYR  48           HD2      TYR  48  13.190   0.771   0.798
  369    HE1  TYR  48           HE1      TYR  48  17.714  -0.306   2.400
  370    HE2  TYR  48           HE2      TYR  48  14.901   2.533   0.910
  371    HH   TYR  48           HH       TYR  48  17.995   1.998   2.426
  372    H    THR  49           H        THR  49  11.647  -4.244   1.835
  373    HA   THR  49           HA       THR  49  12.896  -6.431   3.263
  374    HB   THR  49           HB       THR  49  11.264  -7.864   2.189
  375    HG1  THR  49           HG1      THR  49   9.842  -6.766   0.604
  376   HG21  THR  49          HG21      THR  49   9.399  -5.677   2.359
  377   HG22  THR  49          HG22      THR  49  10.465  -5.689   3.740
  378   HG23  THR  49          HG23      THR  49   9.520  -7.110   3.322
  379    H    ASP  50           H        ASP  50  13.569  -8.405   1.913
  380    HA   ASP  50           HA       ASP  50  15.852  -7.732   0.457
  381    HB2  ASP  50           HB3      ASP  50  15.872  -9.955   1.147
  382    HB3  ASP  50           HB2      ASP  50  14.148 -10.230   0.709
  383    H    ALA  51           H        ALA  51  12.545  -8.226  -0.659
  384    HA   ALA  51           HA       ALA  51  13.143  -8.128  -3.458
  385    HB1  ALA  51           HB1      ALA  51  10.985  -8.775  -3.603
  386    HB2  ALA  51           HB2      ALA  51  10.490  -7.212  -2.919
  387    HB3  ALA  51           HB3      ALA  51  10.855  -8.556  -1.861
  388    H    ASN  52           H        ASN  52  12.004  -5.678  -1.112
  389    HA   ASN  52           HA       ASN  52  11.743  -3.563  -2.964
  390    HB2  ASN  52           HB3      ASN  52  12.436  -3.530  -0.009
  391    HB3  ASN  52           HB2      ASN  52  11.964  -2.096  -0.944
  392   HD21  ASN  52          HD21      ASN  52  10.152  -4.150  -2.448
  393   HD22  ASN  52          HD22      ASN  52   8.770  -4.213  -1.451
  394    H    LYS  53           H        LYS  53  14.515  -4.616  -1.003
  395    HA   LYS  53           HA       LYS  53  16.262  -2.518  -1.696
  396    HB2  LYS  53           HB3      LYS  53  18.073  -4.218  -1.166
  397    HB3  LYS  53           HB2      LYS  53  16.875  -3.895   0.082
  398    HG2  LYS  53           HG3      LYS  53  15.771  -5.947  -0.368
  399    HG3  LYS  53           HG2      LYS  53  16.723  -6.215  -1.830
  400    HD2  LYS  53           HD3      LYS  53  17.821  -7.584  -0.398
  401    HD3  LYS  53           HD2      LYS  53  18.726  -6.099  -0.110
  402    HE2  LYS  53           HE3      LYS  53  18.177  -6.135   2.056
  403    HE3  LYS  53           HE2      LYS  53  16.493  -6.065   1.621
  404    HZ1  LYS  53           HZ1      LYS  53  17.993  -8.285   2.625
  405    HZ2  LYS  53           HZ2      LYS  53  17.156  -8.650   1.179
  406    HZ3  LYS  53           HZ3      LYS  53  16.317  -8.064   2.552
  407    H    ASN  54           H        ASN  54  15.289  -5.434  -3.400
  408    HA   ASN  54           HA       ASN  54  17.341  -5.315  -5.402
  409    HB2  ASN  54           HB3      ASN  54  14.710  -6.777  -5.386
  410    HB3  ASN  54           HB2      ASN  54  16.023  -7.043  -6.499
  411   HD21  ASN  54          HD21      ASN  54  17.337  -6.287  -3.618
  412   HD22  ASN  54          HD22      ASN  54  17.598  -7.921  -2.997
  413    H    LYS  55           H        LYS  55  14.390  -3.663  -4.817
  414    HA   LYS  55           HA       LYS  55  13.368  -1.964  -5.945
  415    HB2  LYS  55           HB3      LYS  55  15.665  -2.462  -7.814
  416    HB3  LYS  55           HB2      LYS  55  14.399  -1.296  -8.167
  417    HG2  LYS  55           HG3      LYS  55  15.222   0.265  -6.720
  418    HG3  LYS  55           HG2      LYS  55  15.543  -0.984  -5.503
  419    HD2  LYS  55           HD3      LYS  55  17.264  -0.152  -7.789
  420    HD3  LYS  55           HD2      LYS  55  17.656  -0.096  -6.095
  421    HE2  LYS  55           HE3      LYS  55  17.250  -2.743  -6.252
  422    HE3  LYS  55           HE2      LYS  55  17.593  -2.450  -7.981
  423    HZ1  LYS  55           HZ1      LYS  55  19.634  -2.944  -7.052
  424    HZ2  LYS  55           HZ2      LYS  55  19.410  -2.014  -5.715
  425    HZ3  LYS  55           HZ3      LYS  55  19.646  -1.257  -7.175
  426    H    GLY  56           H        GLY  56  11.902  -4.039  -6.022
  427    HA2  GLY  56           HA3      GLY  56  11.519  -5.512  -8.288
  428    HA3  GLY  56           HA2      GLY  56  10.227  -5.121  -7.146
  429    H    ILE  57           H        ILE  57   8.658  -3.716  -7.745
  430    HA   ILE  57           HA       ILE  57   9.184  -1.922  -9.946
  431    HB   ILE  57           HB       ILE  57   8.014  -4.295 -10.550
  432   HG12  ILE  57          HG13      ILE  57   8.926  -3.178 -12.340
  433   HG13  ILE  57          HG12      ILE  57   7.227  -2.826 -12.635
  434   HG21  ILE  57          HG21      ILE  57   5.921  -3.970  -9.561
  435   HG22  ILE  57          HG22      ILE  57   5.714  -3.559 -11.277
  436   HG23  ILE  57          HG23      ILE  57   5.869  -2.251 -10.104
  437   HD11  ILE  57          HD11      ILE  57   7.456  -0.626 -12.066
  438   HD12  ILE  57          HD12      ILE  57   9.086  -0.936 -12.547
  439   HD13  ILE  57          HD13      ILE  57   8.695  -0.962 -10.831
  440    H    THR  58           H        THR  58   7.172  -0.518 -10.420
  441    HA   THR  58           HA       THR  58   6.310   0.521  -7.876
  442    HB   THR  58           HB       THR  58   6.739   1.553 -10.448
  443    HG1  THR  58           HG1      THR  58   6.292   3.573  -9.354
  444   HG21  THR  58          HG21      THR  58   4.388   1.059 -10.984
  445   HG22  THR  58          HG22      THR  58   4.788   2.777 -11.007
  446   HG23  THR  58          HG23      THR  58   3.890   2.101  -9.668
  447    H    TRP  59           H        TRP  59   4.641  -0.240  -6.891
  448    HA   TRP  59           HA       TRP  59   2.669  -1.907  -8.028
  449    HB2  TRP  59           HB3      TRP  59   1.976  -0.551  -5.495
  450    HB3  TRP  59           HB2      TRP  59   1.970  -2.247  -5.859
  451    HD1  TRP  59           HD1      TRP  59   4.456   0.582  -4.835
  452    HE1  TRP  59           HE1      TRP  59   6.487  -0.562  -3.739
  453    HE3  TRP  59           HE3      TRP  59   3.278  -4.373  -5.607
  454    HZ2  TRP  59           HZ2      TRP  59   7.468  -3.174  -3.219
  455    HZ3  TRP  59           HZ3      TRP  59   4.797  -6.081  -4.805
  456    HH2  TRP  59           HH2      TRP  59   6.876  -5.512  -3.642
  457    H    LYS  60           H        LYS  60   1.260  -1.245  -9.510
  458    HA   LYS  60           HA       LYS  60   0.015   1.436  -9.193
  459    HB2  LYS  60           HB3      LYS  60   0.377   1.539 -11.380
  460    HB3  LYS  60           HB2      LYS  60   1.006  -0.119 -11.424
  461    HG2  LYS  60           HG3      LYS  60  -0.748  -0.424 -12.821
  462    HG3  LYS  60           HG2      LYS  60  -1.701  -0.525 -11.345
  463    HD2  LYS  60           HD3      LYS  60  -2.814   1.350 -11.704
  464    HD3  LYS  60           HD2      LYS  60  -1.348   2.222 -12.208
  465    HE2  LYS  60           HE3      LYS  60  -1.974   0.274 -14.209
  466    HE3  LYS  60           HE2      LYS  60  -3.469   1.202 -13.824
  467    HZ1  LYS  60           HZ1      LYS  60  -1.507   2.016 -15.534
  468    HZ2  LYS  60           HZ2      LYS  60  -1.179   2.890 -14.081
  469    HZ3  LYS  60           HZ3      LYS  60  -2.711   3.020 -14.783
  470    H    GLU  61           H        GLU  61  -2.304   1.487 -10.048
  471    HA   GLU  61           HA       GLU  61  -3.939  -0.055  -8.293
  472    HB2  GLU  61           HB3      GLU  61  -4.270   2.174  -9.957
  473    HB3  GLU  61           HB2      GLU  61  -5.363   0.947 -10.626
  474    HG2  GLU  61           HG3      GLU  61  -5.644   0.897  -7.807
  475    HG3  GLU  61           HG2      GLU  61  -5.780   2.593  -8.404
  476    H    GLU  62           H        GLU  62  -3.670  -0.270 -11.875
  477    HA   GLU  62           HA       GLU  62  -5.292  -2.568 -12.119
  478    HB2  GLU  62           HB3      GLU  62  -4.791  -2.506 -14.363
  479    HB3  GLU  62           HB2      GLU  62  -4.391  -0.829 -13.891
  480    HG2  GLU  62           HG3      GLU  62  -2.009  -1.462 -13.673
  481    HG3  GLU  62           HG2      GLU  62  -2.454  -3.091 -14.280
  482    H    THR  63           H        THR  63  -1.778  -2.179 -11.868
  483    HA   THR  63           HA       THR  63  -1.111  -4.877 -12.202
  484    HB   THR  63           HB       THR  63   0.294  -2.502 -11.707
  485    HG1  THR  63           HG1      THR  63   1.616  -3.554 -12.929
  486   HG21  THR  63          HG21      THR  63   1.791  -2.807 -10.011
  487   HG22  THR  63          HG22      THR  63   1.517  -4.550  -9.951
  488   HG23  THR  63          HG23      THR  63   0.314  -3.465  -9.295
  489    H    LEU  64           H        LEU  64  -2.207  -3.090  -9.454
  490    HA   LEU  64           HA       LEU  64  -1.511  -4.985  -7.465
  491    HB2  LEU  64           HB3      LEU  64  -2.969  -2.476  -7.643
  492    HB3  LEU  64           HB2      LEU  64  -3.634  -3.581  -6.485
  493    HG   LEU  64           HG       LEU  64  -0.818  -2.591  -6.444
  494   HD11  LEU  64          HD11      LEU  64  -1.874  -0.843  -5.510
  495   HD12  LEU  64          HD12      LEU  64  -1.827  -1.882  -4.122
  496   HD13  LEU  64          HD13      LEU  64  -3.305  -1.833  -5.057
  497   HD21  LEU  64          HD21      LEU  64  -0.538  -3.872  -4.421
  498   HD22  LEU  64          HD22      LEU  64  -1.071  -4.969  -5.716
  499   HD23  LEU  64          HD23      LEU  64  -2.176  -4.447  -4.495
  500    H    MET  65           H        MET  65  -4.312  -4.488  -9.517
  501    HA   MET  65           HA       MET  65  -6.121  -6.159  -8.205
  502    HB2  MET  65           HB3      MET  65  -5.814  -5.361 -11.134
  503    HB3  MET  65           HB2      MET  65  -7.134  -6.392 -10.540
  504    HG2  MET  65           HG3      MET  65  -6.555  -3.508  -9.784
  505    HG3  MET  65           HG2      MET  65  -7.939  -4.157 -10.660
  506    HE1  MET  65           HE1      MET  65  -6.457  -3.075  -7.448
  507    HE2  MET  65           HE2      MET  65  -6.041  -4.753  -7.171
  508    HE3  MET  65           HE3      MET  65  -7.276  -3.976  -6.130
  509    H    GLU  66           H        GLU  66  -3.677  -6.811 -10.705
  510    HA   GLU  66           HA       GLU  66  -4.335  -9.607 -10.871
  511    HB2  GLU  66           HB3      GLU  66  -2.100  -9.644 -12.169
  512    HB3  GLU  66           HB2      GLU  66  -3.456  -8.769 -12.867
  513    HG2  GLU  66           HG3      GLU  66  -2.544  -6.669 -12.111
  514    HG3  GLU  66           HG2      GLU  66  -1.228  -7.506 -11.286
  515    H    TYR  67           H        TYR  67  -1.965  -7.642  -9.271
  516    HA   TYR  67           HA       TYR  67  -0.232  -9.665  -8.349
  517    HB2  TYR  67           HB3      TYR  67   0.794  -7.656  -8.062
  518    HB3  TYR  67           HB2      TYR  67  -0.779  -6.829  -7.631
  519    HD1  TYR  67           HD1      TYR  67   2.146  -8.601  -6.350
  520    HD2  TYR  67           HD2      TYR  67  -1.690  -6.947  -5.342
  521    HE1  TYR  67           HE1      TYR  67   2.730  -8.653  -3.948
  522    HE2  TYR  67           HE2      TYR  67  -1.119  -7.033  -2.990
  523    HH   TYR  67           HH       TYR  67   0.726  -7.205  -1.508
  524    H    LEU  68           H        LEU  68  -3.364  -8.668  -7.367
  525    HA   LEU  68           HA       LEU  68  -3.334  -9.515  -4.686
  526    HB2  LEU  68           HB3      LEU  68  -5.537  -9.159  -6.700
  527    HB3  LEU  68           HB2      LEU  68  -5.868  -9.828  -5.149
  528    HG   LEU  68           HG       LEU  68  -4.607  -7.140  -5.542
  529   HD11  LEU  68          HD11      LEU  68  -6.729  -6.154  -5.186
  530   HD12  LEU  68          HD12      LEU  68  -7.439  -7.699  -4.836
  531   HD13  LEU  68          HD13      LEU  68  -6.938  -7.331  -6.485
  532   HD21  LEU  68          HD21      LEU  68  -4.065  -8.145  -3.431
  533   HD22  LEU  68          HD22      LEU  68  -5.806  -8.496  -3.126
  534   HD23  LEU  68          HD23      LEU  68  -5.208  -6.806  -3.185
  535    H    GLU  69           H        GLU  69  -3.205 -11.265  -7.596
  536    HA   GLU  69           HA       GLU  69  -4.579 -13.622  -6.916
  537    HB2  GLU  69           HB3      GLU  69  -3.166 -12.730  -9.080
  538    HB3  GLU  69           HB2      GLU  69  -2.134 -14.049  -8.503
  539    HG2  GLU  69           HG3      GLU  69  -3.989 -15.585  -8.595
  540    HG3  GLU  69           HG2      GLU  69  -5.056 -14.306  -9.183
  541    H    ASN  70           H        ASN  70  -0.993 -13.545  -7.220
  542    HA   ASN  70           HA       ASN  70  -0.858 -15.123  -4.672
  543    HB2  ASN  70           HB3      ASN  70   0.585 -15.426  -7.362
  544    HB3  ASN  70           HB2      ASN  70   1.400 -15.938  -5.856
  545   HD21  ASN  70          HD21      ASN  70  -0.966 -16.714  -8.199
  546   HD22  ASN  70          HD22      ASN  70  -1.502 -18.204  -7.509
  547    HA   PRO  71           HA       PRO  71   1.189 -11.151  -3.620
  548    HB2  PRO  71           HB3      PRO  71   1.153 -12.666  -1.049
  549    HB3  PRO  71           HB2      PRO  71   0.741 -10.954  -1.369
  550    HG2  PRO  71           HG3      PRO  71  -1.141 -12.794  -0.954
  551    HG3  PRO  71           HG2      PRO  71  -1.341 -11.514  -2.204
  552    HD2  PRO  71           HD3      PRO  71  -0.723 -14.396  -2.519
  553    HD3  PRO  71           HD2      PRO  71  -1.699 -13.341  -3.553
  554    H    LYS  72           H        LYS  72   2.134 -14.475  -2.866
  555    HA   LYS  72           HA       LYS  72   4.827 -13.769  -2.247
  556    HB2  LYS  72           HB3      LYS  72   4.833 -15.813  -1.283
  557    HB3  LYS  72           HB2      LYS  72   3.158 -16.010  -1.881
  558    HG2  LYS  72           HG3      LYS  72   4.147 -17.864  -2.760
  559    HG3  LYS  72           HG2      LYS  72   4.386 -16.723  -4.082
  560    HD2  LYS  72           HD3      LYS  72   6.547 -16.445  -2.288
  561    HD3  LYS  72           HD2      LYS  72   6.374 -18.179  -2.729
  562    HE2  LYS  72           HE3      LYS  72   6.060 -16.714  -5.110
  563    HE3  LYS  72           HE2      LYS  72   7.464 -16.003  -4.271
  564    HZ1  LYS  72           HZ1      LYS  72   8.396 -18.222  -4.143
  565    HZ2  LYS  72           HZ2      LYS  72   8.073 -17.835  -5.741
  566    HZ3  LYS  72           HZ3      LYS  72   7.040 -18.892  -4.847
  567    H    LYS  73           H        LYS  73   3.036 -14.605  -5.074
  568    HA   LYS  73           HA       LYS  73   5.242 -15.498  -6.700
  569    HB2  LYS  73           HB3      LYS  73   3.735 -15.588  -8.426
  570    HB3  LYS  73           HB2      LYS  73   2.667 -15.684  -7.070
  571    HG2  LYS  73           HG3      LYS  73   1.547 -14.071  -8.178
  572    HG3  LYS  73           HG2      LYS  73   2.689 -13.024  -7.363
  573    HD2  LYS  73           HD3      LYS  73   2.329 -12.735  -9.885
  574    HD3  LYS  73           HD2      LYS  73   3.992 -12.833  -9.297
  575    HE2  LYS  73           HE3      LYS  73   3.493 -14.227 -11.368
  576    HE3  LYS  73           HE2      LYS  73   4.240 -15.106 -10.034
  577    HZ1  LYS  73           HZ1      LYS  73   1.874 -15.690  -9.399
  578    HZ2  LYS  73           HZ2      LYS  73   2.504 -16.443 -10.817
  579    HZ3  LYS  73           HZ3      LYS  73   1.417 -15.139 -10.891
  580    H    TYR  74           H        TYR  74   3.954 -12.359  -5.925
  581    HA   TYR  74           HA       TYR  74   5.472 -11.013  -7.979
  582    HB2  TYR  74           HB3      TYR  74   3.526 -10.222  -5.850
  583    HB3  TYR  74           HB2      TYR  74   4.755  -9.008  -6.269
  584    HD1  TYR  74           HD1      TYR  74   2.214 -11.315  -7.827
  585    HD2  TYR  74           HD2      TYR  74   4.420  -7.634  -8.154
  586    HE1  TYR  74           HE1      TYR  74   0.892 -10.677  -9.792
  587    HE2  TYR  74           HE2      TYR  74   3.095  -7.025 -10.106
  588    HH   TYR  74           HH       TYR  74   0.824  -9.247 -11.624
  589    H    ILE  75           H        ILE  75   5.673 -11.413  -4.460
  590    HA   ILE  75           HA       ILE  75   8.505 -10.641  -4.621
  591    HB   ILE  75           HB       ILE  75   6.481  -9.686  -2.581
  592   HG12  ILE  75          HG13      ILE  75   6.594  -8.157  -4.337
  593   HG13  ILE  75          HG12      ILE  75   7.768  -7.500  -3.200
  594   HG21  ILE  75          HG21      ILE  75   8.497  -8.630  -1.408
  595   HG22  ILE  75          HG22      ILE  75   9.482  -9.752  -2.361
  596   HG23  ILE  75          HG23      ILE  75   8.284 -10.353  -1.216
  597   HD11  ILE  75          HD11      ILE  75   9.063  -7.380  -4.994
  598   HD12  ILE  75          HD12      ILE  75   8.153  -8.572  -5.894
  599   HD13  ILE  75          HD13      ILE  75   9.303  -9.131  -4.729
  600    HA   PRO  76           HA       PRO  76   7.975 -14.845  -2.631
  601    HB2  PRO  76           HB3      PRO  76  10.684 -15.072  -3.858
  602    HB3  PRO  76           HB2      PRO  76   9.354 -16.220  -3.912
  603    HG2  PRO  76           HG3      PRO  76  10.049 -14.741  -6.058
  604    HG3  PRO  76           HG2      PRO  76   8.314 -15.046  -5.708
  605    HD2  PRO  76           HD3      PRO  76   9.928 -12.574  -5.220
  606    HD3  PRO  76           HD2      PRO  76   8.219 -12.710  -5.758
  607    H    GLY  77           H        GLY  77   8.602 -15.312  -0.619
  608    HA2  GLY  77           HA3      GLY  77  10.372 -15.541   1.011
  609    HA3  GLY  77           HA2      GLY  77  11.123 -14.103   0.368
  610    H    THR  78           H        THR  78   8.265 -12.911   0.211
  611    HA   THR  78           HA       THR  78   8.343 -11.875   2.975
  612    HB   THR  78           HB       THR  78   8.180 -10.575   0.558
  613    HG1  THR  78           HG1      THR  78   7.222  -9.585   3.019
  614   HG21  THR  78          HG21      THR  78   5.739 -11.368   0.456
  615   HG22  THR  78          HG22      THR  78   6.113  -9.668   0.176
  616   HG23  THR  78          HG23      THR  78   5.488 -10.167   1.759
  617    H    LYS  79           H        LYS  79   6.816 -12.347   4.409
  618    HA   LYS  79           HA       LYS  79   4.404 -13.773   3.450
  619    HB2  LYS  79           HB3      LYS  79   6.143 -14.787   5.155
  620    HB3  LYS  79           HB2      LYS  79   5.340 -13.737   6.297
  621    HG2  LYS  79           HG3      LYS  79   4.545 -16.210   5.969
  622    HG3  LYS  79           HG2      LYS  79   3.320 -14.916   6.217
  623    HD2  LYS  79           HD3      LYS  79   2.798 -16.496   4.338
  624    HD3  LYS  79           HD2      LYS  79   2.971 -14.869   3.807
  625    HE2  LYS  79           HE3      LYS  79   4.059 -16.464   2.297
  626    HE3  LYS  79           HE2      LYS  79   5.153 -15.240   2.938
  627    HZ1  LYS  79           HZ1      LYS  79   6.081 -17.540   2.984
  628    HZ2  LYS  79           HZ2      LYS  79   4.848 -17.968   4.123
  629    HZ3  LYS  79           HZ3      LYS  79   6.003 -16.834   4.518
  630    H    MET  80           H        MET  80   2.375 -13.018   4.120
  631    HA   MET  80           HA       MET  80   2.426 -10.423   5.426
  632    HB2  MET  80           HB3      MET  80   1.294 -10.782   3.112
  633    HB3  MET  80           HB2      MET  80   0.067 -11.665   4.024
  634    HG2  MET  80           HG3      MET  80  -0.886  -9.561   3.950
  635    HG3  MET  80           HG2      MET  80  -0.005  -9.448   5.430
  636    HE1  MET  80           HE1      MET  80   2.074  -9.565   2.172
  637    HE2  MET  80           HE2      MET  80   1.916  -7.918   1.591
  638    HE3  MET  80           HE3      MET  80   0.541  -8.986   1.572
  639    H    ILE  81           H        ILE  81   2.088 -10.454   7.130
  640    HA   ILE  81           HA       ILE  81   0.292 -12.509   8.629
  641    HB   ILE  81           HB       ILE  81   2.276 -10.598   9.971
  642   HG12  ILE  81          HG13      ILE  81   3.180 -13.057  10.502
  643   HG13  ILE  81          HG12      ILE  81   2.257 -13.434   9.047
  644   HG21  ILE  81          HG21      ILE  81   1.249 -12.851  11.564
  645   HG22  ILE  81          HG22      ILE  81   0.120 -11.505  11.319
  646   HG23  ILE  81          HG23      ILE  81   1.707 -11.218  12.049
  647   HD11  ILE  81          HD11      ILE  81   4.312 -12.984   8.155
  648   HD12  ILE  81          HD12      ILE  81   4.698 -11.766   9.374
  649   HD13  ILE  81          HD13      ILE  81   3.569 -11.383   8.079
  650    H    PHE  82           H        PHE  82  -1.695 -11.925   9.795
  651    HA   PHE  82           HA       PHE  82  -3.233 -10.600  10.866
  652    HB2  PHE  82           HB3      PHE  82  -1.139  -9.118  11.414
  653    HB3  PHE  82           HB2      PHE  82  -1.768  -8.095  10.162
  654    HD1  PHE  82           HD1      PHE  82  -2.403  -9.405  13.528
  655    HD2  PHE  82           HD2      PHE  82  -3.767  -6.778  10.453
  656    HE1  PHE  82           HE1      PHE  82  -3.916  -8.370  15.137
  657    HE2  PHE  82           HE2      PHE  82  -5.342  -5.724  12.055
  658    HZ   PHE  82           HZ       PHE  82  -5.382  -6.493  14.401
  659    H    ALA  83           H        ALA  83  -4.924  -8.951  10.269
  660    HA   ALA  83           HA       ALA  83  -5.454  -7.521   8.182
  661    HB1  ALA  83           HB1      ALA  83  -6.184  -9.317   6.375
  662    HB2  ALA  83           HB2      ALA  83  -4.868 -10.253   7.145
  663    HB3  ALA  83           HB3      ALA  83  -4.515  -8.675   6.438
  664    H    GLY  84           H        GLY  84  -7.150  -7.078   9.619
  665    HA2  GLY  84           HA3      GLY  84  -9.166  -9.021  10.142
  666    HA3  GLY  84           HA2      GLY  84  -9.173  -7.354  10.665
  667    H    ILE  85           H        ILE  85  -8.556  -7.816   7.362
  668    HA   ILE  85           HA       ILE  85 -11.395  -7.491   6.645
  669    HB   ILE  85           HB       ILE  85  -9.064  -5.860   5.544
  670   HG12  ILE  85          HG13      ILE  85 -10.624  -5.441   7.792
  671   HG13  ILE  85          HG12      ILE  85  -9.613  -4.223   6.963
  672   HG21  ILE  85          HG21      ILE  85 -12.014  -5.784   4.785
  673   HG22  ILE  85          HG22      ILE  85 -10.692  -6.482   3.804
  674   HG23  ILE  85          HG23      ILE  85 -10.773  -4.750   4.167
  675   HD11  ILE  85          HD11      ILE  85 -11.742  -3.919   5.504
  676   HD12  ILE  85          HD12      ILE  85 -11.654  -3.211   7.112
  677   HD13  ILE  85          HD13      ILE  85 -12.592  -4.700   6.891
  678    H    LYS  86           H        LYS  86 -12.018  -8.281   4.658
  679    HA   LYS  86           HA       LYS  86 -10.014  -9.577   2.939
  680    HB2  LYS  86           HB3      LYS  86 -11.651 -11.634   3.002
  681    HB3  LYS  86           HB2      LYS  86 -10.309 -11.475   4.148
  682    HG2  LYS  86           HG3      LYS  86 -12.549 -10.202   5.253
  683    HG3  LYS  86           HG2      LYS  86 -13.051 -11.768   4.706
  684    HD2  LYS  86           HD3      LYS  86 -11.594 -12.865   6.155
  685    HD3  LYS  86           HD2      LYS  86 -10.487 -11.463   6.225
  686    HE2  LYS  86           HE3      LYS  86 -12.614 -10.339   7.351
  687    HE3  LYS  86           HE2      LYS  86 -13.047 -11.987   7.699
  688    HZ1  LYS  86           HZ1      LYS  86 -10.374 -10.985   8.385
  689    HZ2  LYS  86           HZ2      LYS  86 -11.136 -12.300   9.006
  690    HZ3  LYS  86           HZ3      LYS  86 -11.675 -10.750   9.455
  691    H    LYS  87           H        LYS  87 -13.403  -8.900   3.639
  692    HA   LYS  87           HA       LYS  87 -14.737  -9.466   1.400
  693    HB2  LYS  87           HB3      LYS  87 -15.040  -7.567   3.422
  694    HB3  LYS  87           HB2      LYS  87 -15.233  -6.663   1.927
  695    HG2  LYS  87           HG3      LYS  87 -17.353  -7.373   1.823
  696    HG3  LYS  87           HG2      LYS  87 -16.718  -9.047   1.586
  697    HD2  LYS  87           HD3      LYS  87 -16.539  -9.139   4.133
  698    HD3  LYS  87           HD2      LYS  87 -17.534  -7.691   4.178
  699    HE2  LYS  87           HE3      LYS  87 -18.827  -9.773   4.451
  700    HE3  LYS  87           HE2      LYS  87 -19.337  -8.757   3.073
  701    HZ1  LYS  87           HZ1      LYS  87 -19.088 -11.268   2.749
  702    HZ2  LYS  87           HZ2      LYS  87 -17.411 -10.913   2.626
  703    HZ3  LYS  87           HZ3      LYS  87 -18.515 -10.202   1.561
  704    H    LYS  88           H        LYS  88 -14.303  -9.358  -0.705
  705    HA   LYS  88           HA       LYS  88 -12.248  -7.922  -1.859
  706    HB2  LYS  88           HB3      LYS  88 -13.394  -9.759  -3.011
  707    HB3  LYS  88           HB2      LYS  88 -14.845  -8.740  -3.128
  708    HG2  LYS  88           HG3      LYS  88 -13.853  -7.257  -4.714
  709    HG3  LYS  88           HG2      LYS  88 -12.245  -7.922  -4.438
  710    HD2  LYS  88           HD3      LYS  88 -14.505  -8.860  -6.124
  711    HD3  LYS  88           HD2      LYS  88 -12.762  -9.102  -6.309
  712    HE2  LYS  88           HE3      LYS  88 -13.726 -11.246  -5.891
  713    HE3  LYS  88           HE2      LYS  88 -12.792 -10.822  -4.464
  714    HZ1  LYS  88           HZ1      LYS  88 -15.429 -11.580  -4.574
  715    HZ2  LYS  88           HZ2      LYS  88 -15.476  -9.948  -4.258
  716    HZ3  LYS  88           HZ3      LYS  88 -14.611 -10.977  -3.269
  717    H    THR  89           H        THR  89 -15.538  -6.910  -1.257
  718    HA   THR  89           HA       THR  89 -15.367  -4.461  -2.779
  719    HB   THR  89           HB       THR  89 -17.535  -4.037  -2.023
  720    HG1  THR  89           HG1      THR  89 -17.390  -3.817   0.099
  721   HG21  THR  89          HG21      THR  89 -17.424  -6.980  -1.355
  722   HG22  THR  89          HG22      THR  89 -17.474  -6.321  -3.023
  723   HG23  THR  89          HG23      THR  89 -18.784  -6.021  -1.874
  724    H    GLU  90           H        GLU  90 -14.516  -5.396   0.498
  725    HA   GLU  90           HA       GLU  90 -14.270  -2.716   1.484
  726    HB2  GLU  90           HB3      GLU  90 -13.062  -5.269   2.569
  727    HB3  GLU  90           HB2      GLU  90 -13.252  -3.747   3.422
  728    HG2  GLU  90           HG3      GLU  90 -15.699  -4.951   2.332
  729    HG3  GLU  90           HG2      GLU  90 -14.949  -5.863   3.584
  730    H    ARG  91           H        ARG  91 -12.009  -5.214   0.351
  731    HA   ARG  91           HA       ARG  91  -9.642  -3.709   0.724
  732    HB2  ARG  91           HB3      ARG  91 -10.190  -5.914  -1.216
  733    HB3  ARG  91           HB2      ARG  91  -8.614  -5.077  -1.094
  734    HG2  ARG  91           HG3      ARG  91  -9.116  -5.747   1.474
  735    HG3  ARG  91           HG2      ARG  91  -9.880  -7.119   0.669
  736    HD2  ARG  91           HD3      ARG  91  -7.259  -6.888  -0.610
  737    HD3  ARG  91           HD2      ARG  91  -7.151  -6.609   1.126
  738    HE   ARG  91           HE       ARG  91  -8.470  -8.786   1.149
  739   HH11  ARG  91          HH11      ARG  91  -6.058  -7.823  -1.171
  740   HH12  ARG  91          HH12      ARG  91  -5.569  -9.395  -1.512
  741   HH21  ARG  91          HH21      ARG  91  -7.824 -10.918   0.726
  742   HH22  ARG  91          HH22      ARG  91  -6.555 -11.201  -0.419
  743    H    GLU  92           H        GLU  92 -11.687  -4.173  -2.214
  744    HA   GLU  92           HA       GLU  92 -10.202  -2.514  -3.918
  745    HB2  GLU  92           HB3      GLU  92 -12.066  -4.138  -4.556
  746    HB3  GLU  92           HB2      GLU  92 -13.201  -2.903  -4.028
  747    HG2  GLU  92           HG3      GLU  92 -12.927  -2.770  -6.423
  748    HG3  GLU  92           HG2      GLU  92 -12.247  -1.331  -5.681
  749    H    ASP  93           H        ASP  93 -12.784  -1.767  -1.679
  750    HA   ASP  93           HA       ASP  93 -13.258   0.904  -2.494
  751    HB2  ASP  93           HB3      ASP  93 -14.816  -0.034  -0.987
  752    HB3  ASP  93           HB2      ASP  93 -13.571  -0.529   0.184
  753    H    GLY  94           H        GLY  94 -11.019  -0.431  -0.003
  754    HA2  GLY  94           HA3      GLY  94  -9.954   2.001   0.893
  755    HA3  GLY  94           HA2      GLY  94  -9.121   0.464   0.919
  756    H    ILE  95           H        ILE  95  -9.144   0.008  -1.960
  757    HA   ILE  95           HA       ILE  95  -6.703   1.274  -2.655
  758    HB   ILE  95           HB       ILE  95  -8.695  -0.454  -4.048
  759   HG12  ILE  95          HG13      ILE  95  -5.734  -0.418  -3.679
  760   HG13  ILE  95          HG12      ILE  95  -6.883  -1.450  -2.903
  761   HG21  ILE  95          HG21      ILE  95  -8.590   0.603  -5.973
  762   HG22  ILE  95          HG22      ILE  95  -6.900   0.066  -6.059
  763   HG23  ILE  95          HG23      ILE  95  -7.278   1.673  -5.398
  764   HD11  ILE  95          HD11      ILE  95  -6.539  -1.515  -5.885
  765   HD12  ILE  95          HD12      ILE  95  -7.276  -2.699  -4.819
  766   HD13  ILE  95          HD13      ILE  95  -5.533  -2.435  -4.804
  767    H    ALA  96           H        ALA  96 -10.102   2.036  -3.415
  768    HA   ALA  96           HA       ALA  96  -9.637   4.053  -5.321
  769    HB1  ALA  96           HB1      ALA  96 -11.871   3.176  -4.935
  770    HB2  ALA  96           HB2      ALA  96 -11.812   4.945  -4.689
  771    HB3  ALA  96           HB3      ALA  96 -11.802   3.869  -3.291
  772    H    TYR  97           H        TYR  97  -9.865   4.308  -1.832
  773    HA   TYR  97           HA       TYR  97  -9.429   7.104  -1.643
  774    HB2  TYR  97           HB3      TYR  97 -10.257   5.981   0.283
  775    HB3  TYR  97           HB2      TYR  97  -8.969   4.833   0.315
  776    HD1  TYR  97           HD1      TYR  97  -7.992   5.129   2.401
  777    HD2  TYR  97           HD2      TYR  97  -8.723   8.495  -0.070
  778    HE1  TYR  97           HE1      TYR  97  -6.733   6.529   3.993
  779    HE2  TYR  97           HE2      TYR  97  -7.462   9.918   1.488
  780    HH   TYR  97           HH       TYR  97  -5.615   8.602   4.154
  781    H    LEU  98           H        LEU  98  -7.249   4.351  -1.851
  782    HA   LEU  98           HA       LEU  98  -4.839   5.701  -1.244
  783    HB2  LEU  98           HB3      LEU  98  -5.652   3.112  -1.878
  784    HB3  LEU  98           HB2      LEU  98  -4.565   3.566  -3.196
  785    HG   LEU  98           HG       LEU  98  -3.815   3.760  -0.282
  786   HD11  LEU  98          HD11      LEU  98  -2.351   1.713  -1.391
  787   HD12  LEU  98          HD12      LEU  98  -3.966   1.442  -2.052
  788   HD13  LEU  98          HD13      LEU  98  -3.702   1.535  -0.306
  789   HD21  LEU  98          HD21      LEU  98  -2.318   3.948  -2.887
  790   HD22  LEU  98          HD22      LEU  98  -1.489   3.763  -1.313
  791   HD23  LEU  98          HD23      LEU  98  -2.491   5.184  -1.642
  792    H    LYS  99           H        LYS  99  -6.700   5.293  -4.168
  793    HA   LYS  99           HA       LYS  99  -4.796   6.092  -6.045
  794    HB2  LYS  99           HB3      LYS  99  -7.774   6.718  -6.247
  795    HB3  LYS  99           HB2      LYS  99  -6.616   6.475  -7.547
  796    HG2  LYS  99           HG3      LYS  99  -7.559   4.400  -5.641
  797    HG3  LYS  99           HG2      LYS  99  -8.047   4.566  -7.311
  798    HD2  LYS  99           HD3      LYS  99  -6.334   2.853  -6.685
  799    HD3  LYS  99           HD2      LYS  99  -5.390   4.456  -7.681
  800    HE2  LYS  99           HE3      LYS  99  -4.201   3.707  -5.957
  801    HE3  LYS  99           HE2      LYS  99  -5.634   3.873  -4.944
  802    HZ1  LYS  99           HZ1      LYS  99  -4.316   1.491  -5.645
  803    HZ2  LYS  99           HZ2      LYS  99  -5.857   1.463  -6.418
  804    HZ3  LYS  99           HZ3      LYS  99  -5.754   1.627  -4.730
  805    H    LYS 100           H        LYS 100  -7.154   8.006  -4.172
  806    HA   LYS 100           HA       LYS 100  -6.290  10.527  -5.292
  807    HB2  LYS 100           HB3      LYS 100  -8.353  10.957  -4.505
  808    HB3  LYS 100           HB2      LYS 100  -8.314   9.558  -3.435
  809    HG2  LYS 100           HG3      LYS 100  -6.979  10.874  -1.813
  810    HG3  LYS 100           HG2      LYS 100  -7.151  12.303  -2.855
  811    HD2  LYS 100           HD3      LYS 100  -9.327  10.769  -1.422
  812    HD3  LYS 100           HD2      LYS 100  -8.823  12.471  -1.165
  813    HE2  LYS 100           HE3      LYS 100  -9.945  11.458  -3.800
  814    HE3  LYS 100           HE2      LYS 100 -10.981  12.096  -2.526
  815    HZ1  LYS 100           HZ1      LYS 100  -9.522  13.525  -4.415
  816    HZ2  LYS 100           HZ2      LYS 100  -8.909  13.922  -2.912
  817    HZ3  LYS 100           HZ3      LYS 100 -10.591  14.103  -3.209
  818    H    ALA 101           H        ALA 101  -5.619   8.635  -2.397
  819    HA   ALA 101           HA       ALA 101  -4.223  10.521  -0.837
  820    HB1  ALA 101           HB1      ALA 101  -3.495   7.612  -0.906
  821    HB2  ALA 101           HB2      ALA 101  -5.047   8.114  -0.311
  822    HB3  ALA 101           HB3      ALA 101  -3.611   8.714   0.483
  823    H    THR 102           H        THR 102  -3.254   8.725  -3.703
  824    HA   THR 102           HA       THR 102  -0.505   9.608  -3.267
  825    HB   THR 102           HB       THR 102  -0.449   7.334  -3.850
  826    HG1  THR 102           HG1      THR 102  -0.927   8.045  -5.550
  827   HG21  THR 102          HG21      THR 102  -2.919   7.863  -5.249
  828   HG22  THR 102          HG22      THR 102  -2.367   6.379  -4.508
  829   HG23  THR 102          HG23      THR 102  -1.837   6.797  -6.144
  830    H    ASN 103           H        ASN 103  -3.413  10.059  -4.925
  831    HA   ASN 103           HA       ASN 103  -2.426  12.502  -6.138
  832    HB2  ASN 103           HB3      ASN 103  -3.802  10.744  -8.111
  833    HB3  ASN 103           HB2      ASN 103  -2.583  11.985  -8.384
  834   HD21  ASN 103          HD21      ASN 103  -3.155   8.693  -7.328
  835   HD22  ASN 103          HD22      ASN 103  -1.587   8.125  -7.664
  836    H    GLU 104           H        GLU 104  -3.878  13.818  -5.358
  837    HA   GLU 104           HA       GLU 104  -6.336  14.351  -6.285
  838    HB2  GLU 104           HB3      GLU 104  -6.472  12.014  -4.466
  839    HB3  GLU 104           HB2      GLU 104  -7.756  13.186  -4.390
  840    HG2  GLU 104           HG3      GLU 104  -7.100  12.436  -7.105
  841    HG3  GLU 104           HG2      GLU 104  -7.688  11.071  -6.122
  842    HHA  HEC 201           HHA      HEC 201   5.220  -5.240   0.535
  843    HHB  HEC 201           HHB      HEC 201  -0.340  -2.491   0.333
  844    HHC  HEC 201           HHC      HEC 201  -2.056  -6.163   5.166
  845    HHD  HEC 201           HHD      HEC 201   4.082  -6.023   6.829
  846   HMA1  HEC 201          HMA1      HEC 201   1.034  -1.135  -1.215
  847   HMA2  HEC 201          HMA2      HEC 201   2.672  -0.310  -0.635
  848   HMA3  HEC 201          HMA3      HEC 201   2.446  -1.572  -1.517
  849   HAA1  HEC 201          HAA1      HEC 201   5.099  -3.057  -1.395
  850   HAA2  HEC 201          HAA2      HEC 201   5.711  -2.441   0.204
  851   HBA1  HEC 201          HBA1      HEC 201   4.261  -0.370  -0.214
  852   HBA2  HEC 201          HBA2      HEC 201   4.003  -0.974  -1.864
  853   HMB1  HEC 201          HMB1      HEC 201  -3.556  -1.979   2.044
  854   HMB2  HEC 201          HMB2      HEC 201  -3.640  -3.243   0.801
  855   HMB3  HEC 201          HMB3      HEC 201  -2.364  -1.999   0.720
  856    HAB  HEC 201           HAB      HEC 201  -3.887  -3.317   4.539
  857   HBB1  HEC 201          HBB1      HEC 201  -5.332  -5.281   2.715
  858   HBB2  HEC 201          HBB2      HEC 201  -4.684  -3.787   2.005
  859   HBB3  HEC 201          HBB3      HEC 201  -5.798  -3.701   3.398
  860   HMC1  HEC 201          HMC1      HEC 201  -0.901  -7.706   8.521
  861   HMC2  HEC 201          HMC2      HEC 201  -1.913  -7.834   6.903
  862   HMC3  HEC 201          HMC3      HEC 201  -0.539  -8.450   7.259
  863    HAC  HEC 201           HAC      HEC 201   2.998  -7.021   8.251
  864   HBC1  HEC 201          HBC1      HEC 201   3.271  -9.409   7.694
  865   HBC2  HEC 201          HBC2      HEC 201   1.619  -9.718   8.266
  866   HBC3  HEC 201          HBC3      HEC 201   2.872  -9.168   9.413
  867   HMD1  HEC 201          HMD1      HEC 201   6.031  -7.236   6.425
  868   HMD2  HEC 201          HMD2      HEC 201   7.197  -5.903   6.037
  869   HMD3  HEC 201          HMD3      HEC 201   7.287  -7.460   5.167
  870   HAD1  HEC 201          HAD1      HEC 201   7.980  -6.456   3.235
  871   HAD2  HEC 201          HAD2      HEC 201   7.622  -5.021   2.281
  872   HBD1  HEC 201          HBD1      HEC 201   7.892  -7.670   1.360
  873   HBD2  HEC 201          HBD2      HEC 201   7.404  -6.283   0.420
  Start of MODEL   11
    1    H1   GLY   1          1H        GLY   1 -19.379   3.953  -0.502
    2    H2   GLY   1          2H        GLY   1 -18.794   3.438  -2.005
    3    H3   GLY   1          3H        GLY   1 -18.957   5.146  -1.679
    4    HA2  GLY   1           HA2      GLY   1 -17.308   3.724   0.241
    5    HA3  GLY   1           HA3      GLY   1 -16.680   3.702  -1.349
    6    H    ASP   2           H        ASP   2 -16.596   5.382   1.464
    7    HA   ASP   2           HA       ASP   2 -16.021   7.899   0.095
    8    HB2  ASP   2           HB3      ASP   2 -16.644   7.575   3.103
    9    HB3  ASP   2           HB2      ASP   2 -16.678   9.069   2.045
   10    H    VAL   3           H        VAL   3 -14.252   9.183   0.942
   11    HA   VAL   3           HA       VAL   3 -11.897   7.675   1.298
   12    HB   VAL   3           HB       VAL   3 -12.593  10.560   1.424
   13   HG11  VAL   3          HG11      VAL   3 -11.299  10.643   3.327
   14   HG12  VAL   3          HG12      VAL   3 -10.108  10.966   2.009
   15   HG13  VAL   3          HG13      VAL   3 -10.235   9.355   2.761
   16   HG21  VAL   3          HG21      VAL   3 -11.830  10.296  -0.647
   17   HG22  VAL   3          HG22      VAL   3 -11.108   8.717  -0.267
   18   HG23  VAL   3          HG23      VAL   3 -10.218  10.234   0.073
   19    H    GLU   4           H        GLU   4 -13.971   9.397   3.622
   20    HA   GLU   4           HA       GLU   4 -12.341   9.127   5.960
   21    HB2  GLU   4           HB3      GLU   4 -14.241  10.548   5.998
   22    HB3  GLU   4           HB2      GLU   4 -15.357   9.210   5.721
   23    HG2  GLU   4           HG3      GLU   4 -14.469   8.325   7.974
   24    HG3  GLU   4           HG2      GLU   4 -13.787   9.903   8.199
   25    H    LYS   5           H        LYS   5 -14.878   6.967   4.734
   26    HA   LYS   5           HA       LYS   5 -14.702   5.064   6.771
   27    HB2  LYS   5           HB3      LYS   5 -15.565   4.611   3.933
   28    HB3  LYS   5           HB2      LYS   5 -15.953   3.604   5.282
   29    HG2  LYS   5           HG3      LYS   5 -16.897   6.065   6.083
   30    HG3  LYS   5           HG2      LYS   5 -17.220   6.017   4.366
   31    HD2  LYS   5           HD3      LYS   5 -17.854   3.552   5.738
   32    HD3  LYS   5           HD2      LYS   5 -18.793   4.928   6.248
   33    HE2  LYS   5           HE3      LYS   5 -20.090   4.753   4.460
   34    HE3  LYS   5           HE2      LYS   5 -18.636   5.000   3.420
   35    HZ1  LYS   5           HZ1      LYS   5 -20.189   2.669   3.776
   36    HZ2  LYS   5           HZ2      LYS   5 -18.611   2.382   4.339
   37    HZ3  LYS   5           HZ3      LYS   5 -18.876   2.942   2.777
   38    H    GLY   6           H        GLY   6 -12.997   5.394   3.683
   39    HA2  GLY   6           HA3      GLY   6 -11.753   2.901   3.670
   40    HA3  GLY   6           HA2      GLY   6 -11.164   4.317   2.841
   41    H    LYS   7           H        LYS   7 -10.709   5.970   4.991
   42    HA   LYS   7           HA       LYS   7  -8.119   5.242   5.615
   43    HB2  LYS   7           HB3      LYS   7  -8.500   7.519   5.868
   44    HB3  LYS   7           HB2      LYS   7 -10.016   7.280   6.693
   45    HG2  LYS   7           HG3      LYS   7  -7.867   6.208   8.245
   46    HG3  LYS   7           HG2      LYS   7  -7.539   7.862   7.793
   47    HD2  LYS   7           HD3      LYS   7 -10.214   7.933   8.497
   48    HD3  LYS   7           HD2      LYS   7  -9.463   6.862   9.717
   49    HE2  LYS   7           HE3      LYS   7  -8.928   8.790  10.741
   50    HE3  LYS   7           HE2      LYS   7  -7.648   8.886   9.564
   51    HZ1  LYS   7           HZ1      LYS   7  -8.545  10.899   9.222
   52    HZ2  LYS   7           HZ2      LYS   7 -10.088  10.432   9.752
   53    HZ3  LYS   7           HZ3      LYS   7  -9.528  10.046   8.179
   54    H    LYS   8           H        LYS   8 -10.888   5.004   7.537
   55    HA   LYS   8           HA       LYS   8  -9.950   3.849   9.978
   56    HB2  LYS   8           HB3      LYS   8 -12.111   4.636  10.270
   57    HB3  LYS   8           HB2      LYS   8 -12.600   4.181   8.614
   58    HG2  LYS   8           HG3      LYS   8 -11.976   1.936  10.506
   59    HG3  LYS   8           HG2      LYS   8 -13.430   2.892  10.790
   60    HD2  LYS   8           HD3      LYS   8 -14.333   2.367   8.664
   61    HD3  LYS   8           HD2      LYS   8 -12.793   1.720   8.093
   62    HE2  LYS   8           HE3      LYS   8 -14.070   0.507  10.497
   63    HE3  LYS   8           HE2      LYS   8 -14.785   0.147   8.903
   64    HZ1  LYS   8           HZ1      LYS   8 -11.900  -0.195   9.514
   65    HZ2  LYS   8           HZ2      LYS   8 -12.742  -0.707   8.166
   66    HZ3  LYS   8           HZ3      LYS   8 -13.017  -1.451   9.691
   67    H    ILE   9           H        ILE   9 -11.066   2.442   6.950
   68    HA   ILE   9           HA       ILE   9 -11.064  -0.231   7.759
   69    HB   ILE   9           HB       ILE   9 -10.879   1.088   5.124
   70   HG12  ILE   9          HG13      ILE   9 -12.735  -1.050   6.212
   71   HG13  ILE   9          HG12      ILE   9 -13.070   0.691   6.198
   72   HG21  ILE   9          HG21      ILE   9 -10.642  -1.981   5.310
   73   HG22  ILE   9          HG22      ILE   9  -9.214  -0.816   5.126
   74   HG23  ILE   9          HG23      ILE   9 -10.508  -0.915   3.923
   75   HD11  ILE   9          HD11      ILE   9 -13.211  -1.331   3.972
   76   HD12  ILE   9          HD12      ILE   9 -12.536   0.330   3.631
   77   HD13  ILE   9          HD13      ILE   9 -14.134   0.241   4.360
   78    H    PHE  10           H        PHE  10  -8.503   1.728   6.290
   79    HA   PHE  10           HA       PHE  10  -6.591  -0.338   6.139
   80    HB2  PHE  10           HB3      PHE  10  -5.998   1.433   4.804
   81    HB3  PHE  10           HB2      PHE  10  -6.554   2.653   5.962
   82    HD1  PHE  10           HD1      PHE  10  -3.703   1.395   4.482
   83    HD2  PHE  10           HD2      PHE  10  -5.211   2.609   8.285
   84    HE1  PHE  10           HE1      PHE  10  -1.428   1.794   5.248
   85    HE2  PHE  10           HE2      PHE  10  -2.887   2.961   9.074
   86    HZ   PHE  10           HZ       PHE  10  -0.986   2.584   7.558
   87    H    VAL  11           H        VAL  11  -7.414   1.986   8.624
   88    HA   VAL  11           HA       VAL  11  -5.277   1.842  10.342
   89    HB   VAL  11           HB       VAL  11  -8.199   2.080  11.008
   90   HG11  VAL  11          HG11      VAL  11  -5.750   2.297  12.758
   91   HG12  VAL  11          HG12      VAL  11  -7.184   1.307  13.001
   92   HG13  VAL  11          HG13      VAL  11  -7.237   3.089  13.177
   93   HG21  VAL  11          HG21      VAL  11  -6.313   3.851   9.855
   94   HG22  VAL  11          HG22      VAL  11  -6.621   4.429  11.531
   95   HG23  VAL  11          HG23      VAL  11  -7.969   4.213  10.357
   96    H    GLN  12           H        GLN  12  -8.255  -0.407  10.289
   97    HA   GLN  12           HA       GLN  12  -6.948  -2.119  12.318
   98    HB2  GLN  12           HB3      GLN  12  -9.309  -3.331  11.085
   99    HB3  GLN  12           HB2      GLN  12  -9.057  -2.882  12.742
  100    HG2  GLN  12           HG3      GLN  12  -9.423  -0.450  11.598
  101    HG3  GLN  12           HG2      GLN  12 -10.495  -1.451  10.636
  102   HE21  GLN  12          HE21      GLN  12 -12.231  -0.273  11.542
  103   HE22  GLN  12          HE22      GLN  12 -12.860  -0.687  13.102
  104    H    LYS  13           H        LYS  13  -8.047  -2.188   9.136
  105    HA   LYS  13           HA       LYS  13  -7.523  -4.170   7.617
  106    HB2  LYS  13           HB3      LYS  13  -7.127  -1.419   7.429
  107    HB3  LYS  13           HB2      LYS  13  -5.616  -2.095   6.855
  108    HG2  LYS  13           HG3      LYS  13  -8.286  -2.145   5.650
  109    HG3  LYS  13           HG2      LYS  13  -6.690  -2.239   4.904
  110    HD2  LYS  13           HD3      LYS  13  -6.554  -4.618   5.736
  111    HD3  LYS  13           HD2      LYS  13  -8.308  -4.489   6.124
  112    HE2  LYS  13           HE3      LYS  13  -6.996  -5.006   3.596
  113    HE3  LYS  13           HE2      LYS  13  -8.740  -5.083   4.003
  114    HZ1  LYS  13           HZ1      LYS  13  -8.932  -2.749   3.544
  115    HZ2  LYS  13           HZ2      LYS  13  -8.236  -3.507   2.203
  116    HZ3  LYS  13           HZ3      LYS  13  -7.294  -2.578   3.274
  117    H    CYS  14           H        CYS  14  -4.824  -2.487   9.145
  118    HA   CYS  14           HA       CYS  14  -3.058  -4.451   9.527
  119    HB2  CYS  14           HB3      CYS  14  -1.698  -4.923   7.619
  120    HB3  CYS  14           HB2      CYS  14  -3.370  -5.588   7.464
  121    H    ALA  15           H        ALA  15  -3.646  -1.467   9.732
  122    HA   ALA  15           HA       ALA  15  -1.528  -0.090   8.537
  123    HB1  ALA  15           HB1      ALA  15  -2.778   0.729  11.127
  124    HB2  ALA  15           HB2      ALA  15  -3.630   0.902   9.589
  125    HB3  ALA  15           HB3      ALA  15  -2.098   1.778   9.870
  126    H    GLN  16           H        GLN  16  -1.621  -1.904  11.520
  127    HA   GLN  16           HA       GLN  16   0.635  -0.871  12.849
  128    HB2  GLN  16           HB3      GLN  16   0.325  -3.833  12.893
  129    HB3  GLN  16           HB2      GLN  16   0.417  -2.685  14.220
  130    HG2  GLN  16           HG3      GLN  16  -2.010  -2.023  13.548
  131    HG3  GLN  16           HG2      GLN  16  -1.974  -3.484  12.595
  132   HE21  GLN  16          HE21      GLN  16  -0.842  -2.686  15.842
  133   HE22  GLN  16          HE22      GLN  16  -1.621  -3.957  16.645
  134    H    CYS  17           H        CYS  17   0.404  -3.122  10.181
  135    HA   CYS  17           HA       CYS  17   3.204  -3.763  10.204
  136    HB2  CYS  17           HB3      CYS  17   1.358  -4.164   7.856
  137    HB3  CYS  17           HB2      CYS  17   2.761  -5.115   8.289
  138    H    HIS  18           H        HIS  18   1.290  -1.241   8.914
  139    HA   HIS  18           HA       HIS  18   3.469  -0.320   7.227
  140    HB2  HIS  18           HB3      HIS  18   0.559   0.488   7.090
  141    HB3  HIS  18           HB2      HIS  18   1.820   0.995   5.970
  142    HD1  HIS  18           HD1      HIS  18   1.581  -0.167   3.840
  143    HD2  HIS  18           HD2      HIS  18   0.636  -2.650   7.091
  144    HE1  HIS  18           HE1      HIS  18   0.986  -2.412   2.873
  145    H    THR  19           H        THR  19   2.961  -0.008  10.193
  146    HA   THR  19           HA       THR  19   3.154   1.603  11.772
  147    HB   THR  19           HB       THR  19   4.610   3.126   9.595
  148    HG1  THR  19           HG1      THR  19   6.401   2.031  10.369
  149   HG21  THR  19          HG21      THR  19   5.019   3.226  12.575
  150   HG22  THR  19          HG22      THR  19   4.127   4.421  11.631
  151   HG23  THR  19          HG23      THR  19   5.817   4.221  11.308
  152    H    VAL  20           H        VAL  20   2.486   3.749  12.469
  153    HA   VAL  20           HA       VAL  20   0.015   4.627  11.161
  154    HB   VAL  20           HB       VAL  20   1.202   5.926  13.591
  155   HG11  VAL  20          HG11      VAL  20  -0.972   6.571  12.265
  156   HG12  VAL  20          HG12      VAL  20  -1.042   6.562  14.031
  157   HG13  VAL  20          HG13      VAL  20  -1.708   5.234  13.069
  158   HG21  VAL  20          HG21      VAL  20   0.177   4.267  15.017
  159   HG22  VAL  20          HG22      VAL  20   1.389   3.541  13.939
  160   HG23  VAL  20          HG23      VAL  20  -0.332   3.332  13.561
  161    H    GLU  21           H        GLU  21   0.576   7.358  12.479
  162    HA   GLU  21           HA       GLU  21   1.280   8.700  10.066
  163    HB2  GLU  21           HB3      GLU  21   1.638  10.310  12.451
  164    HB3  GLU  21           HB2      GLU  21   0.473  10.485  11.148
  165    HG2  GLU  21           HG3      GLU  21  -0.969   8.808  12.241
  166    HG3  GLU  21           HG2      GLU  21   0.207   8.695  13.543
  167    H    LYS  22           H        LYS  22   3.182   9.850   9.510
  168    HA   LYS  22           HA       LYS  22   5.607   8.701  10.030
  169    HB2  LYS  22           HB3      LYS  22   4.936  10.326   8.196
  170    HB3  LYS  22           HB2      LYS  22   5.353  11.603   9.316
  171    HG2  LYS  22           HG3      LYS  22   7.144   9.504   8.187
  172    HG3  LYS  22           HG2      LYS  22   7.226  11.243   7.926
  173    HD2  LYS  22           HD3      LYS  22   7.724   9.824  10.497
  174    HD3  LYS  22           HD2      LYS  22   8.956  10.576   9.493
  175    HE2  LYS  22           HE3      LYS  22   8.017  12.781   9.893
  176    HE3  LYS  22           HE2      LYS  22   6.652  12.031  10.779
  177    HZ1  LYS  22           HZ1      LYS  22   9.143  12.830  11.763
  178    HZ2  LYS  22           HZ2      LYS  22   9.048  11.134  11.974
  179    HZ3  LYS  22           HZ3      LYS  22   7.805  12.167  12.602
  180    H    GLY  23           H        GLY  23   6.865   8.655  11.790
  181    HA2  GLY  23           HA3      GLY  23   7.976  10.531  13.258
  182    HA3  GLY  23           HA2      GLY  23   6.382  10.581  13.935
  183    H    GLY  24           H        GLY  24   5.939   7.713  13.582
  184    HA2  GLY  24           HA3      GLY  24   7.094   6.858  16.063
  185    HA3  GLY  24           HA2      GLY  24   5.997   5.958  15.066
  186    H    LYS  25           H        LYS  25   6.969   4.059  14.571
  187    HA   LYS  25           HA       LYS  25   9.798   4.099  13.858
  188    HB2  LYS  25           HB3      LYS  25   8.679   1.466  14.340
  189    HB3  LYS  25           HB2      LYS  25  10.094   2.191  15.107
  190    HG2  LYS  25           HG3      LYS  25   8.932   2.947  16.857
  191    HG3  LYS  25           HG2      LYS  25   7.453   3.159  15.985
  192    HD2  LYS  25           HD3      LYS  25   8.647   0.537  16.882
  193    HD3  LYS  25           HD2      LYS  25   7.233   1.342  17.619
  194    HE2  LYS  25           HE3      LYS  25   5.947   0.354  16.111
  195    HE3  LYS  25           HE2      LYS  25   6.839   1.068  14.783
  196    HZ1  LYS  25           HZ1      LYS  25   6.919  -1.620  15.821
  197    HZ2  LYS  25           HZ2      LYS  25   8.450  -1.010  15.649
  198    HZ3  LYS  25           HZ3      LYS  25   7.395  -1.053  14.332
  199    H    HIS  26           H        HIS  26  10.506   2.653  12.115
  200    HA   HIS  26           HA       HIS  26   8.886   2.926   9.820
  201    HB2  HIS  26           HB3      HIS  26  10.798   0.826   9.474
  202    HB3  HIS  26           HB2      HIS  26  10.864   2.444   8.850
  203    HD1  HIS  26           HD1      HIS  26  11.569   0.800  12.212
  204    HD2  HIS  26           HD2      HIS  26  13.121   3.695   9.613
  205    HE1  HIS  26           HE1      HIS  26  13.663   1.648  13.315
  206    HE2  HIS  26           HE2      HIS  26  14.513   3.461  11.786
  207    H    LYS  27           H        LYS  27   7.617   1.471   8.700
  208    HA   LYS  27           HA       LYS  27   6.594  -0.742  10.278
  209    HB2  LYS  27           HB3      LYS  27   4.736  -0.659   8.878
  210    HB3  LYS  27           HB2      LYS  27   5.262   1.013   8.785
  211    HG2  LYS  27           HG3      LYS  27   6.645  -0.268   6.736
  212    HG3  LYS  27           HG2      LYS  27   5.003  -0.942   6.712
  213    HD2  LYS  27           HD3      LYS  27   5.432   1.157   5.356
  214    HD3  LYS  27           HD2      LYS  27   4.010   1.111   6.334
  215    HE2  LYS  27           HE3      LYS  27   4.624   2.807   7.592
  216    HE3  LYS  27           HE2      LYS  27   6.254   2.106   7.843
  217    HZ1  LYS  27           HZ1      LYS  27   7.009   3.093   5.826
  218    HZ2  LYS  27           HZ2      LYS  27   6.198   4.311   6.636
  219    HZ3  LYS  27           HZ3      LYS  27   5.457   3.552   5.334
  220    H    THR  28           H        THR  28   5.999  -2.742   8.881
  221    HA   THR  28           HA       THR  28   8.423  -4.000   8.086
  222    HB   THR  28           HB       THR  28   5.818  -5.176   7.316
  223    HG1  THR  28           HG1      THR  28   6.603  -5.207   9.993
  224   HG21  THR  28          HG21      THR  28   6.735  -7.223   7.923
  225   HG22  THR  28          HG22      THR  28   7.919  -6.455   8.965
  226   HG23  THR  28          HG23      THR  28   8.096  -6.348   7.202
  227    H    GLY  29           H        GLY  29   5.623  -2.682   6.336
  228    HA2  GLY  29           HA3      GLY  29   7.241  -2.781   3.858
  229    HA3  GLY  29           HA2      GLY  29   5.605  -3.349   3.849
  230    HA   PRO  30           HA       PRO  30   6.406   1.425   3.081
  231    HB2  PRO  30           HB3      PRO  30   5.351   0.451   0.458
  232    HB3  PRO  30           HB2      PRO  30   6.458   1.763   0.760
  233    HG2  PRO  30           HG3      PRO  30   7.371  -0.576  -0.132
  234    HG3  PRO  30           HG2      PRO  30   8.305   0.389   1.081
  235    HD2  PRO  30           HD3      PRO  30   6.687  -2.145   1.470
  236    HD3  PRO  30           HD2      PRO  30   8.085  -1.517   2.378
  237    H    ASN  31           H        ASN  31   4.755   2.471   3.962
  238    HA   ASN  31           HA       ASN  31   2.206   1.486   4.398
  239    HB2  ASN  31           HB3      ASN  31   3.517   3.590   5.320
  240    HB3  ASN  31           HB2      ASN  31   2.528   4.424   4.099
  241   HD21  ASN  31          HD21      ASN  31   1.874   5.338   6.332
  242   HD22  ASN  31          HD22      ASN  31   0.447   4.635   7.010
  243    H    LEU  32           H        LEU  32   3.083   4.070   2.028
  244    HA   LEU  32           HA       LEU  32   1.608   3.007  -0.018
  245    HB2  LEU  32           HB3      LEU  32  -0.289   4.516  -0.281
  246    HB3  LEU  32           HB2      LEU  32  -0.325   3.556   1.188
  247    HG   LEU  32           HG       LEU  32  -1.375   5.685   1.751
  248   HD11  LEU  32          HD11      LEU  32   1.289   5.313   2.692
  249   HD12  LEU  32          HD12      LEU  32  -0.138   4.632   3.471
  250   HD13  LEU  32          HD13      LEU  32   0.129   6.374   3.492
  251   HD21  LEU  32          HD21      LEU  32  -0.602   7.647   0.989
  252   HD22  LEU  32          HD22      LEU  32   0.068   6.571  -0.237
  253   HD23  LEU  32          HD23      LEU  32   1.059   7.089   1.133
  254    H    HIS  33           H        HIS  33   3.087   5.732   1.517
  255    HA   HIS  33           HA       HIS  33   3.162   7.682  -0.492
  256    HB2  HIS  33           HB3      HIS  33   4.473   7.211   1.954
  257    HB3  HIS  33           HB2      HIS  33   5.795   7.386   0.807
  258    HD1  HIS  33           HD1      HIS  33   6.425   9.658   1.945
  259    HD2  HIS  33           HD2      HIS  33   2.614   9.574   0.201
  260    HE1  HIS  33           HE1      HIS  33   5.645  12.035   1.801
  261    HE2  HIS  33           HE2      HIS  33   3.382  11.943   0.814
  262    H    GLY  34           H        GLY  34   3.896   7.740  -2.451
  263    HA2  GLY  34           HA3      GLY  34   5.235   7.342  -4.304
  264    HA3  GLY  34           HA2      GLY  34   6.376   6.573  -3.246
  265    H    LEU  35           H        LEU  35   3.198   5.362  -3.061
  266    HA   LEU  35           HA       LEU  35   3.933   2.766  -3.819
  267    HB2  LEU  35           HB3      LEU  35   1.994   3.320  -2.353
  268    HB3  LEU  35           HB2      LEU  35   1.152   3.926  -3.797
  269    HG   LEU  35           HG       LEU  35   1.093   1.684  -4.726
  270   HD11  LEU  35          HD11      LEU  35   2.294  -0.104  -3.982
  271   HD12  LEU  35          HD12      LEU  35   2.171   0.416  -2.304
  272   HD13  LEU  35          HD13      LEU  35   3.361   1.188  -3.350
  273   HD21  LEU  35          HD21      LEU  35   0.108   2.071  -1.912
  274   HD22  LEU  35          HD22      LEU  35  -0.176   0.532  -2.788
  275   HD23  LEU  35          HD23      LEU  35  -0.795   2.073  -3.426
  276    H    PHE  36           H        PHE  36   2.113   5.241  -5.564
  277    HA   PHE  36           HA       PHE  36   2.484   3.675  -8.045
  278    HB2  PHE  36           HB3      PHE  36   0.588   5.934  -7.971
  279    HB3  PHE  36           HB2      PHE  36   0.444   4.446  -8.841
  280    HD1  PHE  36           HD1      PHE  36  -0.564   2.508  -7.844
  281    HD2  PHE  36           HD2      PHE  36  -0.042   6.126  -5.601
  282    HE1  PHE  36           HE1      PHE  36  -2.157   1.680  -6.116
  283    HE2  PHE  36           HE2      PHE  36  -1.605   5.297  -3.868
  284    HZ   PHE  36           HZ       PHE  36  -2.603   3.075  -4.099
  285    H    GLY  37           H        GLY  37   4.238   5.782  -6.563
  286    HA2  GLY  37           HA3      GLY  37   4.720   7.418  -8.938
  287    HA3  GLY  37           HA2      GLY  37   4.869   8.052  -7.352
  288    H    ARG  38           H        ARG  38   6.125   5.844  -6.107
  289    HA   ARG  38           HA       ARG  38   8.816   6.273  -7.109
  290    HB2  ARG  38           HB3      ARG  38   7.789   4.900  -4.631
  291    HB3  ARG  38           HB2      ARG  38   9.492   5.023  -5.058
  292    HG2  ARG  38           HG3      ARG  38   9.164   7.569  -5.121
  293    HG3  ARG  38           HG2      ARG  38   7.610   7.235  -4.346
  294    HD2  ARG  38           HD3      ARG  38   8.572   7.024  -2.331
  295    HD3  ARG  38           HD2      ARG  38   9.665   5.788  -3.014
  296    HE   ARG  38           HE       ARG  38  11.265   7.401  -2.724
  297   HH11  ARG  38          HH11      ARG  38   8.322   8.919  -3.788
  298   HH12  ARG  38          HH12      ARG  38   9.043  10.502  -3.943
  299   HH21  ARG  38          HH21      ARG  38  12.250   9.460  -2.887
  300   HH22  ARG  38          HH22      ARG  38  11.287  10.798  -3.401
  301    H    LYS  39           H        LYS  39  10.367   4.327  -7.078
  302    HA   LYS  39           HA       LYS  39   9.590   2.534  -9.044
  303    HB2  LYS  39           HB3      LYS  39  11.938   3.041  -8.437
  304    HB3  LYS  39           HB2      LYS  39  11.734   2.171  -6.957
  305    HG2  LYS  39           HG3      LYS  39  12.732   1.074  -9.256
  306    HG3  LYS  39           HG2      LYS  39  12.041   0.149  -7.959
  307    HD2  LYS  39           HD3      LYS  39  11.063  -0.545 -10.086
  308    HD3  LYS  39           HD2      LYS  39   9.849   0.216  -9.029
  309    HE2  LYS  39           HE3      LYS  39  10.425   2.437 -10.261
  310    HE3  LYS  39           HE2      LYS  39  11.165   1.348 -11.456
  311    HZ1  LYS  39           HZ1      LYS  39   9.229   0.561 -12.172
  312    HZ2  LYS  39           HZ2      LYS  39   8.661   2.029 -11.625
  313    HZ3  LYS  39           HZ3      LYS  39   8.448   0.676 -10.660
  314    H    THR  40           H        THR  40  10.723   0.939  -6.169
  315    HA   THR  40           HA       THR  40   8.144   0.018  -5.303
  316    HB   THR  40           HB       THR  40   8.643  -2.250  -5.076
  317    HG1  THR  40           HG1      THR  40  10.123  -3.445  -6.030
  318   HG21  THR  40          HG21      THR  40   8.321  -2.008  -7.827
  319   HG22  THR  40          HG22      THR  40   8.607  -2.845  -6.616
  320   HG23  THR  40          HG23      THR  40   7.216  -2.863  -6.313
  321    H    GLY  41           H        GLY  41   8.077   0.449  -3.571
  322    HA2  GLY  41           HA3      GLY  41   8.579   0.519  -1.358
  323    HA3  GLY  41           HA2      GLY  41   9.245  -1.095  -1.589
  324    H    GLN  42           H        GLN  42  10.471   1.923  -3.022
  325    HA   GLN  42           HA       GLN  42  13.008   1.442  -1.651
  326    HB2  GLN  42           HB3      GLN  42  13.509   3.436  -3.448
  327    HB3  GLN  42           HB2      GLN  42  13.738   1.731  -3.761
  328    HG2  GLN  42           HG3      GLN  42  12.528   2.914  -5.561
  329    HG3  GLN  42           HG2      GLN  42  11.606   1.568  -4.813
  330   HE21  GLN  42          HE21      GLN  42   9.562   2.030  -4.835
  331   HE22  GLN  42          HE22      GLN  42   8.848   3.568  -4.332
  332    H    ALA  43           H        ALA  43  11.100   2.462  -0.014
  333    HA   ALA  43           HA       ALA  43  10.856   5.236   0.137
  334    HB1  ALA  43           HB1      ALA  43  11.032   4.396   2.800
  335    HB2  ALA  43           HB2      ALA  43  10.449   2.961   1.937
  336    HB3  ALA  43           HB3      ALA  43   9.560   4.453   1.788
  337    HA   PRO  44           HA       PRO  44  14.698   6.776   1.721
  338    HB2  PRO  44           HB3      PRO  44  14.067   8.461   3.706
  339    HB3  PRO  44           HB2      PRO  44  13.585   8.757   2.043
  340    HG2  PRO  44           HG3      PRO  44  11.994   7.637   4.298
  341    HG3  PRO  44           HG2      PRO  44  11.491   8.803   3.072
  342    HD2  PRO  44           HD3      PRO  44  10.893   6.126   2.950
  343    HD3  PRO  44           HD2      PRO  44  10.969   7.207   1.572
  344    H    GLY  45           H        GLY  45  13.825   7.325   4.924
  345    HA2  GLY  45           HA3      GLY  45  15.838   5.641   5.987
  346    HA3  GLY  45           HA2      GLY  45  14.696   6.567   6.898
  347    H    PHE  46           H        PHE  46  13.016   4.725   4.740
  348    HA   PHE  46           HA       PHE  46  12.142   2.915   6.815
  349    HB2  PHE  46           HB3      PHE  46  10.490   3.910   5.268
  350    HB3  PHE  46           HB2      PHE  46  11.287   3.110   3.938
  351    HD1  PHE  46           HD1      PHE  46   9.493   2.407   7.117
  352    HD2  PHE  46           HD2      PHE  46  10.693   0.964   3.282
  353    HE1  PHE  46           HE1      PHE  46   8.065   0.462   7.433
  354    HE2  PHE  46           HE2      PHE  46   9.240  -0.969   3.570
  355    HZ   PHE  46           HZ       PHE  46   7.931  -1.266   5.628
  356    H    THR  47           H        THR  47  12.563   0.798   7.047
  357    HA   THR  47           HA       THR  47  14.781  -0.302   5.549
  358    HB   THR  47           HB       THR  47  13.829  -0.615   8.112
  359    HG1  THR  47           HG1      THR  47  15.562  -2.140   8.249
  360   HG21  THR  47          HG21      THR  47  13.515  -3.087   8.260
  361   HG22  THR  47          HG22      THR  47  13.235  -3.090   6.520
  362   HG23  THR  47          HG23      THR  47  12.149  -2.198   7.587
  363    H    TYR  48           H        TYR  48  14.248  -0.857   3.525
  364    HA   TYR  48           HA       TYR  48  11.752  -1.999   2.819
  365    HB2  TYR  48           HB3      TYR  48  13.660  -2.467   0.741
  366    HB3  TYR  48           HB2      TYR  48  12.375  -1.298   0.763
  367    HD1  TYR  48           HD1      TYR  48  15.820  -1.829   2.147
  368    HD2  TYR  48           HD2      TYR  48  13.005   0.955   0.611
  369    HE1  TYR  48           HE1      TYR  48  17.523  -0.041   2.194
  370    HE2  TYR  48           HE2      TYR  48  14.664   2.716   0.666
  371    HH   TYR  48           HH       TYR  48  17.804   2.232   2.166
  372    H    THR  49           H        THR  49  11.453  -4.112   1.745
  373    HA   THR  49           HA       THR  49  12.748  -6.195   3.198
  374    HB   THR  49           HB       THR  49  11.185  -7.662   2.136
  375    HG1  THR  49           HG1      THR  49   9.731  -6.645   0.560
  376   HG21  THR  49          HG21      THR  49   9.230  -5.534   2.257
  377   HG22  THR  49          HG22      THR  49  10.333  -5.529   3.658
  378   HG23  THR  49          HG23      THR  49   9.397  -6.980   3.298
  379    H    ASP  50           H        ASP  50  13.460  -8.246   1.852
  380    HA   ASP  50           HA       ASP  50  15.720  -7.546   0.379
  381    HB2  ASP  50           HB3      ASP  50  15.735  -9.777   1.092
  382    HB3  ASP  50           HB2      ASP  50  14.074 -10.062   0.687
  383    H    ALA  51           H        ALA  51  12.415  -8.066  -0.690
  384    HA   ALA  51           HA       ALA  51  12.947  -8.070  -3.493
  385    HB1  ALA  51           HB1      ALA  51  10.837  -8.681  -3.611
  386    HB2  ALA  51           HB2      ALA  51  10.327  -7.139  -2.962
  387    HB3  ALA  51           HB3      ALA  51  10.681  -8.468  -1.859
  388    H    ASN  52           H        ASN  52  11.833  -5.586  -1.206
  389    HA   ASN  52           HA       ASN  52  11.505  -3.499  -3.092
  390    HB2  ASN  52           HB3      ASN  52  12.231  -3.369  -0.158
  391    HB3  ASN  52           HB2      ASN  52  11.769  -1.936  -1.099
  392   HD21  ASN  52          HD21      ASN  52   9.986  -4.092  -2.513
  393   HD22  ASN  52          HD22      ASN  52   8.584  -4.146  -1.504
  394    H    LYS  53           H        LYS  53  14.344  -4.442  -1.111
  395    HA   LYS  53           HA       LYS  53  16.036  -2.320  -1.881
  396    HB2  LYS  53           HB3      LYS  53  17.860  -4.045  -1.362
  397    HB3  LYS  53           HB2      LYS  53  16.696  -3.718  -0.043
  398    HG2  LYS  53           HG3      LYS  53  15.605  -5.815  -0.462
  399    HG3  LYS  53           HG2      LYS  53  16.519  -6.092  -1.926
  400    HD2  LYS  53           HD3      LYS  53  17.685  -7.369  -0.473
  401    HD3  LYS  53           HD2      LYS  53  18.550  -5.848  -0.255
  402    HE2  LYS  53           HE3      LYS  53  18.070  -5.903   1.932
  403    HE3  LYS  53           HE2      LYS  53  16.325  -5.832   1.548
  404    HZ1  LYS  53           HZ1      LYS  53  17.849  -8.059   2.524
  405    HZ2  LYS  53           HZ2      LYS  53  17.009  -8.431   1.105
  406    HZ3  LYS  53           HZ3      LYS  53  16.179  -7.818   2.446
  407    H    ASN  54           H        ASN  54  15.102  -5.319  -3.512
  408    HA   ASN  54           HA       ASN  54  17.110  -5.192  -5.493
  409    HB2  ASN  54           HB3      ASN  54  14.518  -6.714  -5.443
  410    HB3  ASN  54           HB2      ASN  54  15.803  -6.955  -6.617
  411   HD21  ASN  54          HD21      ASN  54  17.154  -6.166  -3.704
  412   HD22  ASN  54          HD22      ASN  54  17.443  -7.763  -3.114
  413    H    LYS  55           H        LYS  55  14.199  -3.600  -4.924
  414    HA   LYS  55           HA       LYS  55  13.117  -1.952  -6.086
  415    HB2  LYS  55           HB3      LYS  55  15.449  -2.386  -7.992
  416    HB3  LYS  55           HB2      LYS  55  14.164  -1.265  -8.367
  417    HG2  LYS  55           HG3      LYS  55  14.946   0.310  -6.901
  418    HG3  LYS  55           HG2      LYS  55  15.318  -0.921  -5.664
  419    HD2  LYS  55           HD3      LYS  55  17.016  -0.098  -8.006
  420    HD3  LYS  55           HD2      LYS  55  17.383  -0.042  -6.302
  421    HE2  LYS  55           HE3      LYS  55  17.015  -2.644  -6.452
  422    HE3  LYS  55           HE2      LYS  55  17.304  -2.411  -8.175
  423    HZ1  LYS  55           HZ1      LYS  55  19.419  -2.866  -7.281
  424    HZ2  LYS  55           HZ2      LYS  55  19.141  -1.876  -5.879
  425    HZ3  LYS  55           HZ3      LYS  55  19.385  -1.161  -7.393
  426    H    GLY  56           H        GLY  56  11.706  -4.023  -6.103
  427    HA2  GLY  56           HA3      GLY  56  11.264  -5.514  -8.367
  428    HA3  GLY  56           HA2      GLY  56  10.039  -5.120  -7.216
  429    H    ILE  57           H        ILE  57   8.419  -3.745  -7.831
  430    HA   ILE  57           HA       ILE  57   8.884  -1.951 -10.055
  431    HB   ILE  57           HB       ILE  57   7.754  -4.405 -10.634
  432   HG12  ILE  57          HG13      ILE  57   8.645  -3.283 -12.437
  433   HG13  ILE  57          HG12      ILE  57   6.911  -2.934 -12.685
  434   HG21  ILE  57          HG21      ILE  57   5.679  -4.020  -9.635
  435   HG22  ILE  57          HG22      ILE  57   5.409  -3.712 -11.329
  436   HG23  ILE  57          HG23      ILE  57   5.589  -2.389 -10.178
  437   HD11  ILE  57          HD11      ILE  57   7.117  -0.748 -12.168
  438   HD12  ILE  57          HD12      ILE  57   8.779  -1.043 -12.684
  439   HD13  ILE  57          HD13      ILE  57   8.401  -1.058 -11.004
  440    H    THR  58           H        THR  58   6.910  -0.600 -10.508
  441    HA   THR  58           HA       THR  58   6.029   0.491  -8.002
  442    HB   THR  58           HB       THR  58   6.455   1.465 -10.634
  443    HG1  THR  58           HG1      THR  58   5.935   3.500  -9.577
  444   HG21  THR  58          HG21      THR  58   4.072   0.915 -11.157
  445   HG22  THR  58          HG22      THR  58   4.457   2.664 -11.199
  446   HG23  THR  58          HG23      THR  58   3.567   1.949  -9.801
  447    H    TRP  59           H        TRP  59   4.374  -0.283  -6.965
  448    HA   TRP  59           HA       TRP  59   2.404  -2.030  -8.108
  449    HB2  TRP  59           HB3      TRP  59   1.725  -0.600  -5.609
  450    HB3  TRP  59           HB2      TRP  59   1.731  -2.313  -5.916
  451    HD1  TRP  59           HD1      TRP  59   4.186   0.519  -4.947
  452    HE1  TRP  59           HE1      TRP  59   6.223  -0.514  -3.850
  453    HE3  TRP  59           HE3      TRP  59   3.066  -4.410  -5.666
  454    HZ2  TRP  59           HZ2      TRP  59   7.264  -3.112  -3.293
  455    HZ3  TRP  59           HZ3      TRP  59   4.628  -6.145  -4.806
  456    HH2  TRP  59           HH2      TRP  59   6.685  -5.502  -3.658
  457    H    LYS  60           H        LYS  60   1.011  -1.378  -9.528
  458    HA   LYS  60           HA       LYS  60  -0.283   1.277  -9.268
  459    HB2  LYS  60           HB3      LYS  60   0.063   1.400 -11.502
  460    HB3  LYS  60           HB2      LYS  60   0.670  -0.285 -11.510
  461    HG2  LYS  60           HG3      LYS  60  -1.057  -0.612 -12.873
  462    HG3  LYS  60           HG2      LYS  60  -2.001  -0.724 -11.401
  463    HD2  LYS  60           HD3      LYS  60  -3.103   1.154 -11.769
  464    HD3  LYS  60           HD2      LYS  60  -1.689   1.985 -12.326
  465    HE2  LYS  60           HE3      LYS  60  -2.302   0.051 -14.262
  466    HE3  LYS  60           HE2      LYS  60  -3.810   0.929 -13.867
  467    HZ1  LYS  60           HZ1      LYS  60  -1.895   1.765 -15.594
  468    HZ2  LYS  60           HZ2      LYS  60  -1.504   2.656 -14.226
  469    HZ3  LYS  60           HZ3      LYS  60  -3.073   2.764 -14.918
  470    H    GLU  61           H        GLU  61  -2.618   1.291 -10.105
  471    HA   GLU  61           HA       GLU  61  -4.186  -0.205  -8.325
  472    HB2  GLU  61           HB3      GLU  61  -4.618   1.976 -10.039
  473    HB3  GLU  61           HB2      GLU  61  -5.645   0.702 -10.716
  474    HG2  GLU  61           HG3      GLU  61  -5.932   0.716  -7.855
  475    HG3  GLU  61           HG2      GLU  61  -6.127   2.367  -8.467
  476    H    GLU  62           H        GLU  62  -3.975  -0.484 -11.879
  477    HA   GLU  62           HA       GLU  62  -5.575  -2.803 -12.071
  478    HB2  GLU  62           HB3      GLU  62  -5.093  -2.775 -14.319
  479    HB3  GLU  62           HB2      GLU  62  -4.716  -1.139 -13.905
  480    HG2  GLU  62           HG3      GLU  62  -2.322  -1.716 -13.684
  481    HG3  GLU  62           HG2      GLU  62  -2.754  -3.360 -14.258
  482    H    THR  63           H        THR  63  -2.030  -2.367 -11.881
  483    HA   THR  63           HA       THR  63  -1.341  -5.077 -12.216
  484    HB   THR  63           HB       THR  63  -0.015  -2.668 -11.774
  485    HG1  THR  63           HG1      THR  63   1.368  -3.738 -12.986
  486   HG21  THR  63          HG21      THR  63   1.551  -2.965 -10.028
  487   HG22  THR  63          HG22      THR  63   1.266  -4.718  -9.978
  488   HG23  THR  63          HG23      THR  63   0.069  -3.568  -9.333
  489    H    LEU  64           H        LEU  64  -2.470  -3.289  -9.475
  490    HA   LEU  64           HA       LEU  64  -1.694  -5.124  -7.447
  491    HB2  LEU  64           HB3      LEU  64  -3.176  -2.605  -7.642
  492    HB3  LEU  64           HB2      LEU  64  -3.867  -3.730  -6.446
  493    HG   LEU  64           HG       LEU  64  -1.033  -2.729  -6.486
  494   HD11  LEU  64          HD11      LEU  64  -2.125  -0.945  -5.559
  495   HD12  LEU  64          HD12      LEU  64  -2.025  -1.964  -4.154
  496   HD13  LEU  64          HD13      LEU  64  -3.513  -1.948  -5.078
  497   HD21  LEU  64          HD21      LEU  64  -0.710  -3.907  -4.445
  498   HD22  LEU  64          HD22      LEU  64  -1.243  -5.035  -5.684
  499   HD23  LEU  64          HD23      LEU  64  -2.376  -4.508  -4.469
  500    H    MET  65           H        MET  65  -4.523  -4.677  -9.511
  501    HA   MET  65           HA       MET  65  -6.312  -6.382  -8.142
  502    HB2  MET  65           HB3      MET  65  -6.056  -5.573 -11.062
  503    HB3  MET  65           HB2      MET  65  -7.360  -6.607 -10.440
  504    HG2  MET  65           HG3      MET  65  -6.789  -3.776  -9.735
  505    HG3  MET  65           HG2      MET  65  -8.227  -4.415 -10.578
  506    HE1  MET  65           HE1      MET  65  -6.697  -3.243  -7.382
  507    HE2  MET  65           HE2      MET  65  -6.232  -4.917  -7.080
  508    HE3  MET  65           HE3      MET  65  -7.474  -4.176  -6.095
  509    H    GLU  66           H        GLU  66  -3.903  -7.007 -10.666
  510    HA   GLU  66           HA       GLU  66  -4.535  -9.824 -10.752
  511    HB2  GLU  66           HB3      GLU  66  -2.310  -9.860 -12.068
  512    HB3  GLU  66           HB2      GLU  66  -3.710  -9.005 -12.769
  513    HG2  GLU  66           HG3      GLU  66  -2.816  -6.897 -12.097
  514    HG3  GLU  66           HG2      GLU  66  -1.454  -7.698 -11.227
  515    H    TYR  67           H        TYR  67  -2.136  -7.774  -9.218
  516    HA   TYR  67           HA       TYR  67  -0.382  -9.801  -8.261
  517    HB2  TYR  67           HB3      TYR  67   0.568  -7.753  -7.980
  518    HB3  TYR  67           HB2      TYR  67  -0.956  -6.974  -7.629
  519    HD1  TYR  67           HD1      TYR  67   1.969  -8.673  -6.301
  520    HD2  TYR  67           HD2      TYR  67  -1.871  -7.031  -5.317
  521    HE1  TYR  67           HE1      TYR  67   2.602  -8.697  -3.877
  522    HE2  TYR  67           HE2      TYR  67  -1.256  -7.089  -2.941
  523    HH   TYR  67           HH       TYR  67   0.607  -7.201  -1.431
  524    H    LEU  68           H        LEU  68  -3.576  -8.810  -7.273
  525    HA   LEU  68           HA       LEU  68  -3.487  -9.616  -4.577
  526    HB2  LEU  68           HB3      LEU  68  -5.709  -9.317  -6.580
  527    HB3  LEU  68           HB2      LEU  68  -6.052  -9.970  -4.988
  528    HG   LEU  68           HG       LEU  68  -4.795  -7.297  -5.476
  529   HD11  LEU  68          HD11      LEU  68  -6.890  -6.292  -5.067
  530   HD12  LEU  68          HD12      LEU  68  -7.648  -7.880  -4.712
  531   HD13  LEU  68          HD13      LEU  68  -7.092  -7.480  -6.371
  532   HD21  LEU  68          HD21      LEU  68  -4.255  -8.239  -3.314
  533   HD22  LEU  68          HD22      LEU  68  -5.930  -8.614  -2.987
  534   HD23  LEU  68          HD23      LEU  68  -5.378  -6.916  -3.148
  535    H    GLU  69           H        GLU  69  -3.394 -11.420  -7.433
  536    HA   GLU  69           HA       GLU  69  -4.709 -13.785  -6.700
  537    HB2  GLU  69           HB3      GLU  69  -3.348 -12.899  -8.919
  538    HB3  GLU  69           HB2      GLU  69  -2.260 -14.164  -8.341
  539    HG2  GLU  69           HG3      GLU  69  -4.110 -15.772  -8.418
  540    HG3  GLU  69           HG2      GLU  69  -5.194 -14.501  -8.978
  541    H    ASN  70           H        ASN  70  -1.158 -13.686  -7.076
  542    HA   ASN  70           HA       ASN  70  -0.923 -15.217  -4.528
  543    HB2  ASN  70           HB3      ASN  70   0.466 -15.515  -7.145
  544    HB3  ASN  70           HB2      ASN  70   1.278 -15.989  -5.638
  545   HD21  ASN  70          HD21      ASN  70  -1.037 -16.842  -8.014
  546   HD22  ASN  70          HD22      ASN  70  -1.588 -18.345  -7.241
  547    HA   PRO  71           HA       PRO  71   1.090 -11.206  -3.560
  548    HB2  PRO  71           HB3      PRO  71   1.070 -12.618  -0.938
  549    HB3  PRO  71           HB2      PRO  71   0.657 -10.975  -1.309
  550    HG2  PRO  71           HG3      PRO  71  -1.255 -12.791  -0.837
  551    HG3  PRO  71           HG2      PRO  71  -1.447 -11.525  -2.066
  552    HD2  PRO  71           HD3      PRO  71  -0.803 -14.420  -2.377
  553    HD3  PRO  71           HD2      PRO  71  -1.827 -13.386  -3.421
  554    H    LYS  72           H        LYS  72   2.052 -14.475  -2.744
  555    HA   LYS  72           HA       LYS  72   4.755 -13.759  -2.106
  556    HB2  LYS  72           HB3      LYS  72   4.739 -15.791  -1.149
  557    HB3  LYS  72           HB2      LYS  72   3.091 -16.021  -1.729
  558    HG2  LYS  72           HG3      LYS  72   4.101 -17.841  -2.598
  559    HG3  LYS  72           HG2      LYS  72   4.284 -16.740  -3.955
  560    HD2  LYS  72           HD3      LYS  72   6.482 -16.428  -2.156
  561    HD3  LYS  72           HD2      LYS  72   6.325 -18.155  -2.526
  562    HE2  LYS  72           HE3      LYS  72   5.952 -16.708  -4.952
  563    HE3  LYS  72           HE2      LYS  72   7.355 -15.977  -4.142
  564    HZ1  LYS  72           HZ1      LYS  72   8.341 -18.175  -3.942
  565    HZ2  LYS  72           HZ2      LYS  72   8.000 -17.833  -5.584
  566    HZ3  LYS  72           HZ3      LYS  72   6.985 -18.886  -4.664
  567    H    LYS  73           H        LYS  73   2.934 -14.646  -4.932
  568    HA   LYS  73           HA       LYS  73   5.136 -15.542  -6.560
  569    HB2  LYS  73           HB3      LYS  73   3.588 -15.673  -8.272
  570    HB3  LYS  73           HB2      LYS  73   2.518 -15.766  -6.880
  571    HG2  LYS  73           HG3      LYS  73   1.407 -14.219  -8.017
  572    HG3  LYS  73           HG2      LYS  73   2.551 -13.122  -7.283
  573    HD2  LYS  73           HD3      LYS  73   2.169 -12.879  -9.807
  574    HD3  LYS  73           HD2      LYS  73   3.833 -12.962  -9.204
  575    HE2  LYS  73           HE3      LYS  73   3.341 -14.343 -11.222
  576    HE3  LYS  73           HE2      LYS  73   4.082 -15.173  -9.906
  577    HZ1  LYS  73           HZ1      LYS  73   1.742 -15.855  -9.214
  578    HZ2  LYS  73           HZ2      LYS  73   2.351 -16.554 -10.627
  579    HZ3  LYS  73           HZ3      LYS  73   1.273 -15.309 -10.764
  580    H    TYR  74           H        TYR  74   3.852 -12.396  -5.788
  581    HA   TYR  74           HA       TYR  74   5.335 -11.096  -7.887
  582    HB2  TYR  74           HB3      TYR  74   3.372 -10.271  -5.784
  583    HB3  TYR  74           HB2      TYR  74   4.584  -9.052  -6.235
  584    HD1  TYR  74           HD1      TYR  74   2.064 -11.372  -7.748
  585    HD2  TYR  74           HD2      TYR  74   4.183  -7.748  -8.127
  586    HE1  TYR  74           HE1      TYR  74   0.711 -10.835  -9.738
  587    HE2  TYR  74           HE2      TYR  74   2.844  -7.147 -10.092
  588    HH   TYR  74           HH       TYR  74   0.609  -9.450 -11.565
  589    H    ILE  75           H        ILE  75   5.575 -11.394  -4.379
  590    HA   ILE  75           HA       ILE  75   8.368 -10.590  -4.577
  591    HB   ILE  75           HB       ILE  75   6.410  -9.633  -2.536
  592   HG12  ILE  75          HG13      ILE  75   6.400  -8.143  -4.332
  593   HG13  ILE  75          HG12      ILE  75   7.583  -7.415  -3.232
  594   HG21  ILE  75          HG21      ILE  75   8.389  -8.571  -1.450
  595   HG22  ILE  75          HG22      ILE  75   9.379  -9.686  -2.352
  596   HG23  ILE  75          HG23      ILE  75   8.197 -10.279  -1.187
  597   HD11  ILE  75          HD11      ILE  75   8.887  -7.345  -5.049
  598   HD12  ILE  75          HD12      ILE  75   7.978  -8.533  -5.909
  599   HD13  ILE  75          HD13      ILE  75   9.180  -9.080  -4.716
  600    HA   PRO  76           HA       PRO  76   7.925 -14.798  -2.524
  601    HB2  PRO  76           HB3      PRO  76  10.596 -15.011  -3.769
  602    HB3  PRO  76           HB2      PRO  76   9.281 -16.161  -3.820
  603    HG2  PRO  76           HG3      PRO  76   9.940 -14.674  -5.980
  604    HG3  PRO  76           HG2      PRO  76   8.252 -15.036  -5.559
  605    HD2  PRO  76           HD3      PRO  76   9.811 -12.506  -5.183
  606    HD3  PRO  76           HD2      PRO  76   8.108 -12.725  -5.661
  607    H    GLY  77           H        GLY  77   8.546 -15.205  -0.537
  608    HA2  GLY  77           HA3      GLY  77  10.303 -15.368   1.121
  609    HA3  GLY  77           HA2      GLY  77  11.059 -13.966   0.435
  610    H    THR  78           H        THR  78   8.215 -12.811   0.283
  611    HA   THR  78           HA       THR  78   8.279 -11.710   3.000
  612    HB   THR  78           HB       THR  78   8.080 -10.467   0.590
  613    HG1  THR  78           HG1      THR  78   7.134  -9.432   3.015
  614   HG21  THR  78          HG21      THR  78   5.648 -11.273   0.561
  615   HG22  THR  78          HG22      THR  78   6.001  -9.587   0.209
  616   HG23  THR  78          HG23      THR  78   5.422 -10.072   1.806
  617    H    LYS  79           H        LYS  79   6.795 -12.193   4.482
  618    HA   LYS  79           HA       LYS  79   4.395 -13.633   3.580
  619    HB2  LYS  79           HB3      LYS  79   6.095 -14.615   5.273
  620    HB3  LYS  79           HB2      LYS  79   5.288 -13.554   6.403
  621    HG2  LYS  79           HG3      LYS  79   4.523 -16.014   6.137
  622    HG3  LYS  79           HG2      LYS  79   3.314 -14.749   6.334
  623    HD2  LYS  79           HD3      LYS  79   2.787 -16.404   4.500
  624    HD3  LYS  79           HD2      LYS  79   2.946 -14.746   3.926
  625    HE2  LYS  79           HE3      LYS  79   4.028 -16.407   2.475
  626    HE3  LYS  79           HE2      LYS  79   5.147 -15.140   3.101
  627    HZ1  LYS  79           HZ1      LYS  79   6.045 -17.405   3.149
  628    HZ2  LYS  79           HZ2      LYS  79   4.854 -17.832   4.307
  629    HZ3  LYS  79           HZ3      LYS  79   6.004 -16.667   4.646
  630    H    MET  80           H        MET  80   2.371 -12.960   4.108
  631    HA   MET  80           HA       MET  80   2.226 -10.316   5.388
  632    HB2  MET  80           HB3      MET  80   0.523 -11.701   3.370
  633    HB3  MET  80           HB2      MET  80  -0.224 -10.493   4.365
  634    HG2  MET  80           HG3      MET  80   2.309  -9.959   2.832
  635    HG3  MET  80           HG2      MET  80   0.733  -9.800   2.058
  636    HE1  MET  80           HE1      MET  80  -0.590  -8.174   2.006
  637    HE2  MET  80           HE2      MET  80  -0.015  -6.525   2.281
  638    HE3  MET  80           HE3      MET  80  -1.151  -7.299   3.450
  639    H    ILE  81           H        ILE  81   1.764 -10.375   7.052
  640    HA   ILE  81           HA       ILE  81  -0.053 -12.466   8.440
  641    HB   ILE  81           HB       ILE  81   1.854 -10.729  10.055
  642   HG12  ILE  81          HG13      ILE  81   3.000 -13.041  10.280
  643   HG13  ILE  81          HG12      ILE  81   2.115 -13.514   8.870
  644   HG21  ILE  81          HG21      ILE  81   0.029 -11.481  11.432
  645   HG22  ILE  81          HG22      ILE  81   1.416 -12.480  11.830
  646   HG23  ILE  81          HG23      ILE  81   0.123 -13.083  10.776
  647   HD11  ILE  81          HD11      ILE  81   3.248 -11.036   8.229
  648   HD12  ILE  81          HD12      ILE  81   3.721 -12.628   7.634
  649   HD13  ILE  81          HD13      ILE  81   4.495 -11.958   9.101
  650    H    PHE  82           H        PHE  82  -2.018 -11.904   9.245
  651    HA   PHE  82           HA       PHE  82  -3.559 -10.613  10.496
  652    HB2  PHE  82           HB3      PHE  82  -1.427  -8.976  10.778
  653    HB3  PHE  82           HB2      PHE  82  -2.334  -8.067   9.554
  654    HD1  PHE  82           HD1      PHE  82  -3.912  -6.507  10.228
  655    HD2  PHE  82           HD2      PHE  82  -2.871  -9.748  12.799
  656    HE1  PHE  82           HE1      PHE  82  -5.299  -5.525  12.003
  657    HE2  PHE  82           HE2      PHE  82  -4.264  -8.800  14.567
  658    HZ   PHE  82           HZ       PHE  82  -5.495  -6.683  14.170
  659    H    ALA  83           H        ALA  83  -5.161  -8.791   9.796
  660    HA   ALA  83           HA       ALA  83  -5.735  -7.660   7.563
  661    HB1  ALA  83           HB1      ALA  83  -6.693  -9.637   6.038
  662    HB2  ALA  83           HB2      ALA  83  -5.426 -10.526   6.871
  663    HB3  ALA  83           HB3      ALA  83  -5.009  -9.110   5.956
  664    H    GLY  84           H        GLY  84  -7.272  -6.953   9.146
  665    HA2  GLY  84           HA3      GLY  84  -9.359  -8.701  10.020
  666    HA3  GLY  84           HA2      GLY  84  -9.259  -6.957  10.298
  667    H    ILE  85           H        ILE  85  -9.109  -8.391   7.098
  668    HA   ILE  85           HA       ILE  85 -11.830  -7.408   6.599
  669    HB   ILE  85           HB       ILE  85  -9.449  -6.979   4.833
  670   HG12  ILE  85          HG13      ILE  85  -9.641  -5.402   6.756
  671   HG13  ILE  85          HG12      ILE  85  -9.867  -4.599   5.182
  672   HG21  ILE  85          HG21      ILE  85 -11.906  -7.465   3.881
  673   HG22  ILE  85          HG22      ILE  85 -10.739  -6.385   3.084
  674   HG23  ILE  85          HG23      ILE  85 -12.008  -5.754   4.110
  675   HD11  ILE  85          HD11      ILE  85 -12.270  -4.636   5.583
  676   HD12  ILE  85          HD12      ILE  85 -11.464  -3.813   6.885
  677   HD13  ILE  85          HD13      ILE  85 -12.053  -5.464   7.084
  678    H    LYS  86           H        LYS  86 -13.122  -8.913   5.685
  679    HA   LYS  86           HA       LYS  86 -11.852 -11.062   4.170
  680    HB2  LYS  86           HB3      LYS  86 -13.781 -12.508   4.986
  681    HB3  LYS  86           HB2      LYS  86 -12.527 -12.096   6.174
  682    HG2  LYS  86           HG3      LYS  86 -13.887 -10.521   7.231
  683    HG3  LYS  86           HG2      LYS  86 -15.051 -10.510   5.904
  684    HD2  LYS  86           HD3      LYS  86 -15.372 -13.010   6.475
  685    HD3  LYS  86           HD2      LYS  86 -14.618 -12.556   7.990
  686    HE2  LYS  86           HE3      LYS  86 -16.515 -11.743   8.755
  687    HE3  LYS  86           HE2      LYS  86 -16.621 -10.607   7.400
  688    HZ1  LYS  86           HZ1      LYS  86 -18.552 -11.900   7.274
  689    HZ2  LYS  86           HZ2      LYS  86 -17.765 -13.320   7.710
  690    HZ3  LYS  86           HZ3      LYS  86 -17.508 -12.690   6.193
  691    H    LYS  87           H        LYS  87 -12.593  -8.855   2.798
  692    HA   LYS  87           HA       LYS  87 -14.625  -9.883   1.072
  693    HB2  LYS  87           HB3      LYS  87 -15.147  -7.577   2.880
  694    HB3  LYS  87           HB2      LYS  87 -15.799  -7.534   1.253
  695    HG2  LYS  87           HG3      LYS  87 -17.099  -9.440   1.611
  696    HG3  LYS  87           HG2      LYS  87 -16.287  -9.814   3.142
  697    HD2  LYS  87           HD3      LYS  87 -17.301  -8.081   4.313
  698    HD3  LYS  87           HD2      LYS  87 -17.706  -7.166   2.813
  699    HE2  LYS  87           HE3      LYS  87 -19.220  -9.141   2.212
  700    HE3  LYS  87           HE2      LYS  87 -19.041  -9.647   3.921
  701    HZ1  LYS  87           HZ1      LYS  87 -19.854  -7.479   4.619
  702    HZ2  LYS  87           HZ2      LYS  87 -21.017  -8.300   3.672
  703    HZ3  LYS  87           HZ3      LYS  87 -20.132  -7.020   3.008
  704    H    LYS  88           H        LYS  88 -13.822  -9.611  -0.881
  705    HA   LYS  88           HA       LYS  88 -11.595  -8.113  -1.562
  706    HB2  LYS  88           HB3      LYS  88 -11.899  -9.071  -3.558
  707    HB3  LYS  88           HB2      LYS  88 -13.393  -9.794  -2.883
  708    HG2  LYS  88           HG3      LYS  88 -13.430  -7.065  -4.131
  709    HG3  LYS  88           HG2      LYS  88 -13.485  -8.497  -5.160
  710    HD2  LYS  88           HD3      LYS  88 -15.359  -9.189  -3.321
  711    HD3  LYS  88           HD2      LYS  88 -15.499  -7.423  -3.224
  712    HE2  LYS  88           HE3      LYS  88 -15.932  -7.263  -5.608
  713    HE3  LYS  88           HE2      LYS  88 -15.597  -8.942  -5.864
  714    HZ1  LYS  88           HZ1      LYS  88 -18.028  -7.824  -5.445
  715    HZ2  LYS  88           HZ2      LYS  88 -17.651  -8.450  -3.855
  716    HZ3  LYS  88           HZ3      LYS  88 -17.677  -9.453  -5.210
  717    H    THR  89           H        THR  89 -15.024  -7.189  -1.564
  718    HA   THR  89           HA       THR  89 -14.673  -4.678  -2.927
  719    HB   THR  89           HB       THR  89 -16.836  -6.023  -2.318
  720    HG1  THR  89           HG1      THR  89 -17.189  -4.164  -3.363
  721   HG21  THR  89          HG21      THR  89 -17.219  -4.176  -0.033
  722   HG22  THR  89          HG22      THR  89 -16.198  -5.610   0.270
  723   HG23  THR  89          HG23      THR  89 -17.878  -5.747  -0.318
  724    H    GLU  90           H        GLU  90 -13.975  -5.718   0.318
  725    HA   GLU  90           HA       GLU  90 -14.003  -3.112   1.515
  726    HB2  GLU  90           HB3      GLU  90 -12.646  -5.633   2.444
  727    HB3  GLU  90           HB2      GLU  90 -12.873  -4.171   3.405
  728    HG2  GLU  90           HG3      GLU  90 -15.220  -5.553   2.211
  729    HG3  GLU  90           HG2      GLU  90 -14.530  -6.149   3.744
  730    H    ARG  91           H        ARG  91 -11.482  -5.298   0.321
  731    HA   ARG  91           HA       ARG  91  -9.274  -3.614   0.848
  732    HB2  ARG  91           HB3      ARG  91  -9.713  -6.015  -1.044
  733    HB3  ARG  91           HB2      ARG  91  -8.154  -5.084  -0.878
  734    HG2  ARG  91           HG3      ARG  91  -8.593  -5.691   1.716
  735    HG3  ARG  91           HG2      ARG  91  -9.385  -7.063   0.914
  736    HD2  ARG  91           HD3      ARG  91  -6.749  -6.868  -0.374
  737    HD3  ARG  91           HD2      ARG  91  -6.641  -6.589   1.362
  738    HE   ARG  91           HE       ARG  91  -7.964  -8.711   1.410
  739   HH11  ARG  91          HH11      ARG  91  -5.575  -7.774  -0.946
  740   HH12  ARG  91          HH12      ARG  91  -5.033  -9.325  -1.212
  741   HH21  ARG  91          HH21      ARG  91  -7.274 -10.853   1.020
  742   HH22  ARG  91          HH22      ARG  91  -6.014 -11.155  -0.113
  743    H    GLU  92           H        GLU  92 -11.203  -4.199  -2.047
  744    HA   GLU  92           HA       GLU  92  -9.745  -2.576  -3.860
  745    HB2  GLU  92           HB3      GLU  92 -12.744  -2.915  -3.886
  746    HB3  GLU  92           HB2      GLU  92 -11.735  -2.555  -5.228
  747    HG2  GLU  92           HG3      GLU  92 -12.458  -5.107  -4.080
  748    HG3  GLU  92           HG2      GLU  92 -11.729  -4.736  -5.652
  749    H    ASP  93           H        ASP  93 -12.276  -1.739  -1.553
  750    HA   ASP  93           HA       ASP  93 -12.730   0.874  -2.349
  751    HB2  ASP  93           HB3      ASP  93 -13.676  -0.720  -0.300
  752    HB3  ASP  93           HB2      ASP  93 -12.788   0.471   0.561
  753    H    GLY  94           H        GLY  94 -10.377  -0.386   0.033
  754    HA2  GLY  94           HA3      GLY  94  -9.294   2.096   0.824
  755    HA3  GLY  94           HA2      GLY  94  -8.424   0.532   0.874
  756    H    ILE  95           H        ILE  95  -8.644   0.082  -2.047
  757    HA   ILE  95           HA       ILE  95  -6.250   1.310  -2.901
  758    HB   ILE  95           HB       ILE  95  -8.430   0.272  -4.691
  759   HG12  ILE  95          HG13      ILE  95  -6.808  -1.125  -2.765
  760   HG13  ILE  95          HG12      ILE  95  -8.150  -1.703  -3.711
  761   HG21  ILE  95          HG21      ILE  95  -6.849   0.072  -6.358
  762   HG22  ILE  95          HG22      ILE  95  -5.505   0.024  -5.202
  763   HG23  ILE  95          HG23      ILE  95  -6.313   1.546  -5.552
  764   HD11  ILE  95          HD11      ILE  95  -6.355  -3.097  -4.276
  765   HD12  ILE  95          HD12      ILE  95  -5.265  -1.711  -4.399
  766   HD13  ILE  95          HD13      ILE  95  -6.502  -1.909  -5.590
  767    H    ALA  96           H        ALA  96  -9.628   2.134  -3.605
  768    HA   ALA  96           HA       ALA  96  -9.167   4.254  -5.429
  769    HB1  ALA  96           HB1      ALA  96 -11.377   4.212  -3.394
  770    HB2  ALA  96           HB2      ALA  96 -11.399   3.186  -4.869
  771    HB3  ALA  96           HB3      ALA  96 -11.365   4.979  -4.983
  772    H    TYR  97           H        TYR  97  -9.293   4.257  -1.860
  773    HA   TYR  97           HA       TYR  97  -9.012   7.056  -1.548
  774    HB2  TYR  97           HB3      TYR  97  -9.841   5.840   0.301
  775    HB3  TYR  97           HB2      TYR  97  -8.450   4.737   0.302
  776    HD1  TYR  97           HD1      TYR  97  -9.946   7.517   1.861
  777    HD2  TYR  97           HD2      TYR  97  -6.159   6.003   0.686
  778    HE1  TYR  97           HE1      TYR  97  -8.815   8.959   3.515
  779    HE2  TYR  97           HE2      TYR  97  -5.013   7.452   2.310
  780    HH   TYR  97           HH       TYR  97  -6.793   9.838   4.137
  781    H    LEU  98           H        LEU  98  -6.743   4.419  -1.815
  782    HA   LEU  98           HA       LEU  98  -4.389   5.867  -1.082
  783    HB2  LEU  98           HB3      LEU  98  -5.073   3.225  -1.910
  784    HB3  LEU  98           HB2      LEU  98  -3.837   3.813  -3.069
  785    HG   LEU  98           HG       LEU  98  -3.274   4.293  -0.193
  786   HD11  LEU  98          HD11      LEU  98  -2.248   1.843  -0.327
  787   HD12  LEU  98          HD12      LEU  98  -3.662   1.593  -1.367
  788   HD13  LEU  98          HD13      LEU  98  -3.889   2.108   0.278
  789   HD21  LEU  98          HD21      LEU  98  -1.489   4.940  -1.459
  790   HD22  LEU  98          HD22      LEU  98  -1.802   3.715  -2.742
  791   HD23  LEU  98          HD23      LEU  98  -1.066   3.238  -1.199
  792    H    LYS  99           H        LYS  99  -6.100   5.366  -4.178
  793    HA   LYS  99           HA       LYS  99  -4.137   6.365  -5.887
  794    HB2  LYS  99           HB3      LYS  99  -6.983   7.029  -6.504
  795    HB3  LYS  99           HB2      LYS  99  -5.761   6.225  -7.528
  796    HG2  LYS  99           HG3      LYS  99  -6.055   4.230  -5.843
  797    HG3  LYS  99           HG2      LYS  99  -7.587   5.030  -5.480
  798    HD2  LYS  99           HD3      LYS  99  -6.977   4.750  -8.330
  799    HD3  LYS  99           HD2      LYS  99  -7.296   3.199  -7.473
  800    HE2  LYS  99           HE3      LYS  99  -9.441   3.765  -7.075
  801    HE3  LYS  99           HE2      LYS  99  -9.125   5.526  -7.057
  802    HZ1  LYS  99           HZ1      LYS  99  -8.867   5.346  -9.481
  803    HZ2  LYS  99           HZ2      LYS  99 -10.429   4.943  -8.975
  804    HZ3  LYS  99           HZ3      LYS  99  -9.351   3.697  -9.433
  805    H    LYS 100           H        LYS 100  -6.719   8.046  -4.099
  806    HA   LYS 100           HA       LYS 100  -6.128  10.640  -5.195
  807    HB2  LYS 100           HB3      LYS 100  -7.778   9.699  -2.839
  808    HB3  LYS 100           HB2      LYS 100  -7.577  11.412  -3.268
  809    HG2  LYS 100           HG3      LYS 100  -9.184  11.243  -4.797
  810    HG3  LYS 100           HG2      LYS 100  -8.339   9.991  -5.626
  811    HD2  LYS 100           HD3      LYS 100  -9.863   8.472  -4.943
  812    HD3  LYS 100           HD2      LYS 100  -9.475   8.867  -3.248
  813    HE2  LYS 100           HE3      LYS 100 -11.319  10.597  -4.936
  814    HE3  LYS 100           HE2      LYS 100 -11.887   9.175  -4.106
  815    HZ1  LYS 100           HZ1      LYS 100 -11.783  11.565  -2.976
  816    HZ2  LYS 100           HZ2      LYS 100 -10.313  10.948  -2.447
  817    HZ3  LYS 100           HZ3      LYS 100 -11.770  10.158  -2.111
  818    H    ALA 101           H        ALA 101  -5.305   8.795  -2.319
  819    HA   ALA 101           HA       ALA 101  -4.134  10.755  -0.756
  820    HB1  ALA 101           HB1      ALA 101  -4.569   8.127  -0.404
  821    HB2  ALA 101           HB2      ALA 101  -3.463   9.103   0.608
  822    HB3  ALA 101           HB3      ALA 101  -2.838   8.068  -0.735
  823    H    THR 102           H        THR 102  -2.916   9.197  -3.609
  824    HA   THR 102           HA       THR 102  -0.300  10.409  -3.189
  825    HB   THR 102           HB       THR 102   0.572   8.713  -4.363
  826    HG1  THR 102           HG1      THR 102  -0.476   7.996  -6.332
  827   HG21  THR 102          HG21      THR 102  -1.769   7.099  -4.814
  828   HG22  THR 102          HG22      THR 102  -1.692   7.726  -3.160
  829   HG23  THR 102          HG23      THR 102  -0.333   6.795  -3.790
  830    H    ASN 103           H        ASN 103  -3.269  10.616  -4.822
  831    HA   ASN 103           HA       ASN 103  -2.546  13.145  -5.903
  832    HB2  ASN 103           HB3      ASN 103  -2.673  12.703  -8.197
  833    HB3  ASN 103           HB2      ASN 103  -1.947  11.188  -7.612
  834   HD21  ASN 103          HD21      ASN 103  -3.307   9.331  -7.495
  835   HD22  ASN 103          HD22      ASN 103  -4.757   9.250  -8.425
  836    H    GLU 104           H        GLU 104  -4.173  14.246  -5.141
  837    HA   GLU 104           HA       GLU 104  -6.621  14.619  -5.984
  838    HB2  GLU 104           HB3      GLU 104  -6.537  12.072  -4.391
  839    HB3  GLU 104           HB2      GLU 104  -7.973  13.125  -4.261
  840    HG2  GLU 104           HG3      GLU 104  -7.370  11.250  -6.274
  841    HG3  GLU 104           HG2      GLU 104  -8.800  12.255  -6.139
  842    HHA  HEC 201           HHA      HEC 201   5.148  -5.244   0.518
  843    HHB  HEC 201           HHB      HEC 201  -0.599  -2.480   0.332
  844    HHC  HEC 201           HHC      HEC 201  -2.194  -6.172   5.239
  845    HHD  HEC 201           HHD      HEC 201   4.012  -5.910   6.836
  846   HMA1  HEC 201          HMA1      HEC 201   0.884  -1.177  -1.309
  847   HMA2  HEC 201          HMA2      HEC 201   2.473  -0.245  -0.790
  848   HMA3  HEC 201          HMA3      HEC 201   2.267  -1.609  -1.619
  849   HAA1  HEC 201          HAA1      HEC 201   4.975  -3.021  -1.504
  850   HAA2  HEC 201          HAA2      HEC 201   5.529  -2.387   0.065
  851   HBA1  HEC 201          HBA1      HEC 201   4.096  -0.273  -0.341
  852   HBA2  HEC 201          HBA2      HEC 201   3.825  -0.993  -1.985
  853   HMB1  HEC 201          HMB1      HEC 201  -3.752  -2.007   2.017
  854   HMB2  HEC 201          HMB2      HEC 201  -3.865  -3.300   0.822
  855   HMB3  HEC 201          HMB3      HEC 201  -2.600  -2.032   0.684
  856    HAB  HEC 201           HAB      HEC 201  -4.057  -3.345   4.551
  857   HBB1  HEC 201          HBB1      HEC 201  -5.523  -5.275   2.752
  858   HBB2  HEC 201          HBB2      HEC 201  -4.874  -3.783   2.039
  859   HBB3  HEC 201          HBB3      HEC 201  -5.973  -3.758   3.404
  860   HMC1  HEC 201          HMC1      HEC 201  -0.941  -7.631   8.556
  861   HMC2  HEC 201          HMC2      HEC 201  -2.034  -7.728   6.974
  862   HMC3  HEC 201          HMC3      HEC 201  -0.606  -8.360   7.316
  863    HAC  HEC 201           HAC      HEC 201   2.958  -6.894   8.441
  864   HBC1  HEC 201          HBC1      HEC 201   3.231  -9.282   7.884
  865   HBC2  HEC 201          HBC2      HEC 201   1.579  -9.591   8.456
  866   HBC3  HEC 201          HBC3      HEC 201   2.832  -9.041   9.603
  867   HMD1  HEC 201          HMD1      HEC 201   5.944  -7.091   6.409
  868   HMD2  HEC 201          HMD2      HEC 201   7.117  -5.785   6.044
  869   HMD3  HEC 201          HMD3      HEC 201   7.190  -7.336   5.171
  870   HAD1  HEC 201          HAD1      HEC 201   7.916  -6.370   3.219
  871   HAD2  HEC 201          HAD2      HEC 201   7.471  -4.971   2.229
  872   HBD1  HEC 201          HBD1      HEC 201   7.794  -7.624   1.324
  873   HBD2  HEC 201          HBD2      HEC 201   7.247  -6.238   0.404
  Start of MODEL   12
    1    H1   GLY   1          1H        GLY   1 -19.304   3.784  -0.312
    2    H2   GLY   1          2H        GLY   1 -18.697   3.258  -1.799
    3    H3   GLY   1          3H        GLY   1 -18.866   4.912  -1.495
    4    HA2  GLY   1           HA2      GLY   1 -17.232   3.543   0.440
    5    HA3  GLY   1           HA3      GLY   1 -16.582   3.504  -1.192
    6    H    ASP   2           H        ASP   2 -16.548   5.270   1.550
    7    HA   ASP   2           HA       ASP   2 -15.973   7.804   0.247
    8    HB2  ASP   2           HB3      ASP   2 -16.567   7.550   3.093
    9    HB3  ASP   2           HB2      ASP   2 -16.621   8.970   2.201
   10    H    VAL   3           H        VAL   3 -14.217   9.102   1.107
   11    HA   VAL   3           HA       VAL   3 -11.859   7.603   1.423
   12    HB   VAL   3           HB       VAL   3 -12.551  10.488   1.558
   13   HG11  VAL   3          HG11      VAL   3 -11.220  10.559   3.457
   14   HG12  VAL   3          HG12      VAL   3 -10.066  10.877   2.162
   15   HG13  VAL   3          HG13      VAL   3 -10.160   9.271   2.885
   16   HG21  VAL   3          HG21      VAL   3 -11.799  10.210  -0.525
   17   HG22  VAL   3          HG22      VAL   3 -11.075   8.647  -0.142
   18   HG23  VAL   3          HG23      VAL   3 -10.186  10.135   0.184
   19    H    GLU   4           H        GLU   4 -13.890   9.329   3.733
   20    HA   GLU   4           HA       GLU   4 -12.245   9.071   5.952
   21    HB2  GLU   4           HB3      GLU   4 -14.165  10.539   5.985
   22    HB3  GLU   4           HB2      GLU   4 -15.257   9.184   5.737
   23    HG2  GLU   4           HG3      GLU   4 -14.363   8.280   7.945
   24    HG3  GLU   4           HG2      GLU   4 -13.675   9.874   8.179
   25    H    LYS   5           H        LYS   5 -14.786   6.929   4.704
   26    HA   LYS   5           HA       LYS   5 -14.608   5.009   6.763
   27    HB2  LYS   5           HB3      LYS   5 -15.479   4.576   3.900
   28    HB3  LYS   5           HB2      LYS   5 -15.866   3.552   5.279
   29    HG2  LYS   5           HG3      LYS   5 -16.777   5.999   6.082
   30    HG3  LYS   5           HG2      LYS   5 -17.126   6.009   4.355
   31    HD2  LYS   5           HD3      LYS   5 -17.794   3.509   5.738
   32    HD3  LYS   5           HD2      LYS   5 -18.725   4.912   6.267
   33    HE2  LYS   5           HE3      LYS   5 -19.997   4.749   4.457
   34    HE3  LYS   5           HE2      LYS   5 -18.579   4.990   3.439
   35    HZ1  LYS   5           HZ1      LYS   5 -20.104   2.654   3.797
   36    HZ2  LYS   5           HZ2      LYS   5 -18.526   2.354   4.326
   37    HZ3  LYS   5           HZ3      LYS   5 -18.796   2.913   2.753
   38    H    GLY   6           H        GLY   6 -12.939   5.376   3.681
   39    HA2  GLY   6           HA3      GLY   6 -11.670   2.862   3.619
   40    HA3  GLY   6           HA2      GLY   6 -11.107   4.311   2.803
   41    H    LYS   7           H        LYS   7 -10.659   5.745   4.767
   42    HA   LYS   7           HA       LYS   7  -8.009   5.130   5.417
   43    HB2  LYS   7           HB3      LYS   7  -8.037   7.351   5.644
   44    HB3  LYS   7           HB2      LYS   7  -9.793   7.363   5.725
   45    HG2  LYS   7           HG3      LYS   7  -9.828   7.429   7.998
   46    HG3  LYS   7           HG2      LYS   7  -8.307   6.550   8.158
   47    HD2  LYS   7           HD3      LYS   7  -8.690   9.441   7.406
   48    HD3  LYS   7           HD2      LYS   7  -7.922   8.800   8.859
   49    HE2  LYS   7           HE3      LYS   7  -6.250   7.695   7.290
   50    HE3  LYS   7           HE2      LYS   7  -6.915   8.730   6.029
   51    HZ1  LYS   7           HZ1      LYS   7  -5.925   9.851   8.578
   52    HZ2  LYS   7           HZ2      LYS   7  -6.166  10.641   7.103
   53    HZ3  LYS   7           HZ3      LYS   7  -4.880   9.557   7.280
   54    H    LYS   8           H        LYS   8 -10.821   4.948   7.513
   55    HA   LYS   8           HA       LYS   8  -9.865   3.831   9.925
   56    HB2  LYS   8           HB3      LYS   8 -12.002   4.574  10.219
   57    HB3  LYS   8           HB2      LYS   8 -12.499   4.120   8.596
   58    HG2  LYS   8           HG3      LYS   8 -11.893   1.915  10.466
   59    HG3  LYS   8           HG2      LYS   8 -13.348   2.859  10.784
   60    HD2  LYS   8           HD3      LYS   8 -14.260   2.340   8.661
   61    HD3  LYS   8           HD2      LYS   8 -12.723   1.692   8.082
   62    HE2  LYS   8           HE3      LYS   8 -13.968   0.443  10.476
   63    HE3  LYS   8           HE2      LYS   8 -14.684   0.114   8.898
   64    HZ1  LYS   8           HZ1      LYS   8 -11.802  -0.259   9.484
   65    HZ2  LYS   8           HZ2      LYS   8 -12.654  -0.794   8.125
   66    HZ3  LYS   8           HZ3      LYS   8 -12.946  -1.496   9.635
   67    H    ILE   9           H        ILE   9 -10.971   2.395   6.895
   68    HA   ILE   9           HA       ILE   9 -11.001  -0.283   7.716
   69    HB   ILE   9           HB       ILE   9 -10.798   1.073   5.079
   70   HG12  ILE   9          HG13      ILE   9 -12.642  -1.067   6.169
   71   HG13  ILE   9          HG12      ILE   9 -12.978   0.662   6.188
   72   HG21  ILE   9          HG21      ILE   9 -10.529  -1.860   5.357
   73   HG22  ILE   9          HG22      ILE   9  -9.157  -0.842   5.096
   74   HG23  ILE   9          HG23      ILE   9 -10.424  -0.930   3.872
   75   HD11  ILE   9          HD11      ILE   9 -13.136  -1.225   4.017
   76   HD12  ILE   9          HD12      ILE   9 -12.484   0.301   3.568
   77   HD13  ILE   9          HD13      ILE   9 -14.086   0.182   4.299
   78    H    PHE  10           H        PHE  10  -8.444   1.672   6.251
   79    HA   PHE  10           HA       PHE  10  -6.501  -0.375   6.102
   80    HB2  PHE  10           HB3      PHE  10  -5.911   1.398   4.768
   81    HB3  PHE  10           HB2      PHE  10  -6.468   2.576   5.877
   82    HD1  PHE  10           HD1      PHE  10  -3.652   1.337   4.423
   83    HD2  PHE  10           HD2      PHE  10  -5.114   2.540   8.235
   84    HE1  PHE  10           HE1      PHE  10  -1.344   1.727   5.182
   85    HE2  PHE  10           HE2      PHE  10  -2.808   2.932   9.002
   86    HZ   PHE  10           HZ       PHE  10  -0.919   2.525   7.473
   87    H    VAL  11           H        VAL  11  -7.341   1.951   8.593
   88    HA   VAL  11           HA       VAL  11  -5.170   1.780  10.264
   89    HB   VAL  11           HB       VAL  11  -8.087   2.034  10.983
   90   HG11  VAL  11          HG11      VAL  11  -5.637   2.218  12.710
   91   HG12  VAL  11          HG12      VAL  11  -7.096   1.261  12.969
   92   HG13  VAL  11          HG13      VAL  11  -7.150   3.017  13.136
   93   HG21  VAL  11          HG21      VAL  11  -6.203   3.806   9.825
   94   HG22  VAL  11          HG22      VAL  11  -6.536   4.372  11.463
   95   HG23  VAL  11          HG23      VAL  11  -7.862   4.142  10.321
   96    H    GLN  12           H        GLN  12  -8.044  -0.378  10.321
   97    HA   GLN  12           HA       GLN  12  -6.739  -2.107  12.339
   98    HB2  GLN  12           HB3      GLN  12  -9.081  -3.293  11.083
   99    HB3  GLN  12           HB2      GLN  12  -8.822  -2.863  12.769
  100    HG2  GLN  12           HG3      GLN  12  -9.207  -0.419  11.634
  101    HG3  GLN  12           HG2      GLN  12 -10.264  -1.442  10.660
  102   HE21  GLN  12          HE21      GLN  12 -12.018  -0.252  11.577
  103   HE22  GLN  12          HE22      GLN  12 -12.611  -0.654  13.148
  104    H    LYS  13           H        LYS  13  -7.822  -2.163   9.162
  105    HA   LYS  13           HA       LYS  13  -7.302  -4.063   7.673
  106    HB2  LYS  13           HB3      LYS  13  -6.899  -1.381   7.426
  107    HB3  LYS  13           HB2      LYS  13  -5.404  -2.104   6.859
  108    HG2  LYS  13           HG3      LYS  13  -8.071  -2.093   5.649
  109    HG3  LYS  13           HG2      LYS  13  -6.479  -2.195   4.896
  110    HD2  LYS  13           HD3      LYS  13  -6.378  -4.531   5.772
  111    HD3  LYS  13           HD2      LYS  13  -8.091  -4.360   6.154
  112    HE2  LYS  13           HE3      LYS  13  -6.830  -4.908   3.632
  113    HE3  LYS  13           HE2      LYS  13  -8.538  -4.954   4.059
  114    HZ1  LYS  13           HZ1      LYS  13  -8.717  -2.618   3.610
  115    HZ2  LYS  13           HZ2      LYS  13  -8.032  -3.375   2.263
  116    HZ3  LYS  13           HZ3      LYS  13  -7.056  -2.490   3.321
  117    H    CYS  14           H        CYS  14  -4.598  -2.470   9.130
  118    HA   CYS  14           HA       CYS  14  -2.873  -4.451   9.528
  119    HB2  CYS  14           HB3      CYS  14  -1.515  -4.869   7.639
  120    HB3  CYS  14           HB2      CYS  14  -3.187  -5.533   7.485
  121    H    ALA  15           H        ALA  15  -3.441  -1.455   9.715
  122    HA   ALA  15           HA       ALA  15  -1.326  -0.125   8.531
  123    HB1  ALA  15           HB1      ALA  15  -2.556   0.718  11.142
  124    HB2  ALA  15           HB2      ALA  15  -3.389   0.870   9.595
  125    HB3  ALA  15           HB3      ALA  15  -1.880   1.741   9.874
  126    H    GLN  16           H        GLN  16  -1.414  -1.923  11.521
  127    HA   GLN  16           HA       GLN  16   0.760  -0.920  12.830
  128    HB2  GLN  16           HB3      GLN  16   0.466  -3.858  12.877
  129    HB3  GLN  16           HB2      GLN  16   0.541  -2.710  14.208
  130    HG2  GLN  16           HG3      GLN  16  -1.766  -2.053  13.550
  131    HG3  GLN  16           HG2      GLN  16  -1.773  -3.510  12.555
  132   HE21  GLN  16          HE21      GLN  16  -0.650  -2.707  15.808
  133   HE22  GLN  16          HE22      GLN  16  -1.411  -4.014  16.607
  134    H    CYS  17           H        CYS  17   0.537  -3.152  10.127
  135    HA   CYS  17           HA       CYS  17   3.333  -3.807  10.129
  136    HB2  CYS  17           HB3      CYS  17   1.484  -4.152   7.781
  137    HB3  CYS  17           HB2      CYS  17   2.879  -5.127   8.232
  138    H    HIS  18           H        HIS  18   1.403  -1.252   8.903
  139    HA   HIS  18           HA       HIS  18   3.608  -0.359   7.172
  140    HB2  HIS  18           HB3      HIS  18   0.705   0.483   7.089
  141    HB3  HIS  18           HB2      HIS  18   1.965   0.985   5.966
  142    HD1  HIS  18           HD1      HIS  18   1.676  -0.188   3.819
  143    HD2  HIS  18           HD2      HIS  18   0.737  -2.633   7.043
  144    HE1  HIS  18           HE1      HIS  18   1.066  -2.413   2.820
  145    H    THR  19           H        THR  19   3.119  -0.029  10.154
  146    HA   THR  19           HA       THR  19   3.296   1.569  11.764
  147    HB   THR  19           HB       THR  19   4.748   3.065   9.575
  148    HG1  THR  19           HG1      THR  19   6.572   1.984  10.333
  149   HG21  THR  19          HG21      THR  19   5.186   3.178  12.513
  150   HG22  THR  19          HG22      THR  19   4.265   4.376  11.603
  151   HG23  THR  19          HG23      THR  19   5.978   4.134  11.261
  152    H    VAL  20           H        VAL  20   2.653   3.706  12.445
  153    HA   VAL  20           HA       VAL  20   0.338   4.559  11.113
  154    HB   VAL  20           HB       VAL  20   1.361   5.906  13.552
  155   HG11  VAL  20          HG11      VAL  20  -0.686   6.548  12.232
  156   HG12  VAL  20          HG12      VAL  20  -0.726   6.496  13.994
  157   HG13  VAL  20          HG13      VAL  20  -1.397   5.162  13.057
  158   HG21  VAL  20          HG21      VAL  20   0.453   4.196  14.967
  159   HG22  VAL  20          HG22      VAL  20   1.555   3.473  13.906
  160   HG23  VAL  20          HG23      VAL  20  -0.066   3.284  13.549
  161    H    GLU  21           H        GLU  21   1.334   7.202  12.448
  162    HA   GLU  21           HA       GLU  21   1.597   8.648  10.068
  163    HB2  GLU  21           HB3      GLU  21   1.926  10.257  12.456
  164    HB3  GLU  21           HB2      GLU  21   0.805  10.435  11.159
  165    HG2  GLU  21           HG3      GLU  21  -0.640   8.775  12.225
  166    HG3  GLU  21           HG2      GLU  21   0.531   8.602  13.532
  167    H    LYS  22           H        LYS  22   3.342   9.792   9.493
  168    HA   LYS  22           HA       LYS  22   5.796   8.647  10.012
  169    HB2  LYS  22           HB3      LYS  22   5.101  10.296   8.168
  170    HB3  LYS  22           HB2      LYS  22   5.529  11.559   9.309
  171    HG2  LYS  22           HG3      LYS  22   7.334   9.459   8.139
  172    HG3  LYS  22           HG2      LYS  22   7.397  11.204   7.883
  173    HD2  LYS  22           HD3      LYS  22   7.922   9.753  10.476
  174    HD3  LYS  22           HD2      LYS  22   9.130  10.520   9.441
  175    HE2  LYS  22           HE3      LYS  22   8.198  12.691   9.867
  176    HE3  LYS  22           HE2      LYS  22   6.839  11.985  10.741
  177    HZ1  LYS  22           HZ1      LYS  22   9.336  12.752  11.746
  178    HZ2  LYS  22           HZ2      LYS  22   9.204  11.074  11.923
  179    HZ3  LYS  22           HZ3      LYS  22   8.027  12.088  12.588
  180    H    GLY  23           H        GLY  23   7.034   8.605  11.739
  181    HA2  GLY  23           HA3      GLY  23   8.193  10.462  13.210
  182    HA3  GLY  23           HA2      GLY  23   6.574  10.534  13.897
  183    H    GLY  24           H        GLY  24   6.109   7.662  13.532
  184    HA2  GLY  24           HA3      GLY  24   7.298   6.784  16.005
  185    HA3  GLY  24           HA2      GLY  24   6.187   5.869  14.996
  186    H    LYS  25           H        LYS  25   7.116   3.984  14.531
  187    HA   LYS  25           HA       LYS  25   9.968   3.977  13.794
  188    HB2  LYS  25           HB3      LYS  25   8.804   1.355  14.270
  189    HB3  LYS  25           HB2      LYS  25  10.237   2.121  14.994
  190    HG2  LYS  25           HG3      LYS  25   9.111   2.847  16.805
  191    HG3  LYS  25           HG2      LYS  25   7.605   3.049  15.927
  192    HD2  LYS  25           HD3      LYS  25   8.829   0.435  16.823
  193    HD3  LYS  25           HD2      LYS  25   7.402   1.236  17.529
  194    HE2  LYS  25           HE3      LYS  25   6.071   0.255  16.048
  195    HE3  LYS  25           HE2      LYS  25   6.992   0.962  14.720
  196    HZ1  LYS  25           HZ1      LYS  25   7.030  -1.724  15.748
  197    HZ2  LYS  25           HZ2      LYS  25   8.575  -1.072  15.530
  198    HZ3  LYS  25           HZ3      LYS  25   7.497  -1.141  14.231
  199    H    HIS  26           H        HIS  26  10.687   2.579  12.123
  200    HA   HIS  26           HA       HIS  26   9.085   2.838   9.824
  201    HB2  HIS  26           HB3      HIS  26  10.985   0.740   9.435
  202    HB3  HIS  26           HB2      HIS  26  11.034   2.393   8.829
  203    HD1  HIS  26           HD1      HIS  26  11.771   0.726  12.182
  204    HD2  HIS  26           HD2      HIS  26  13.298   3.614   9.614
  205    HE1  HIS  26           HE1      HIS  26  13.875   1.556  13.281
  206    HE2  HIS  26           HE2      HIS  26  14.730   3.369  11.755
  207    H    LYS  27           H        LYS  27   7.755   1.409   8.648
  208    HA   LYS  27           HA       LYS  27   6.690  -0.816  10.190
  209    HB2  LYS  27           HB3      LYS  27   4.831  -0.697   8.829
  210    HB3  LYS  27           HB2      LYS  27   5.397   0.965   8.742
  211    HG2  LYS  27           HG3      LYS  27   6.735  -0.312   6.680
  212    HG3  LYS  27           HG2      LYS  27   5.112  -1.007   6.649
  213    HD2  LYS  27           HD3      LYS  27   5.558   1.133   5.285
  214    HD3  LYS  27           HD2      LYS  27   4.102   1.059   6.281
  215    HE2  LYS  27           HE3      LYS  27   4.769   2.781   7.530
  216    HE3  LYS  27           HE2      LYS  27   6.366   2.073   7.771
  217    HZ1  LYS  27           HZ1      LYS  27   7.146   3.044   5.782
  218    HZ2  LYS  27           HZ2      LYS  27   6.316   4.270   6.600
  219    HZ3  LYS  27           HZ3      LYS  27   5.590   3.490   5.286
  220    H    THR  28           H        THR  28   6.076  -2.816   8.806
  221    HA   THR  28           HA       THR  28   8.496  -4.046   7.984
  222    HB   THR  28           HB       THR  28   5.873  -5.242   7.233
  223    HG1  THR  28           HG1      THR  28   6.703  -5.268   9.922
  224   HG21  THR  28          HG21      THR  28   6.832  -7.175   7.859
  225   HG22  THR  28          HG22      THR  28   8.007  -6.519   8.883
  226   HG23  THR  28          HG23      THR  28   8.198  -6.292   7.176
  227    H    GLY  29           H        GLY  29   5.727  -2.711   6.250
  228    HA2  GLY  29           HA3      GLY  29   7.327  -2.849   3.779
  229    HA3  GLY  29           HA2      GLY  29   5.658  -3.402   3.774
  230    HA   PRO  30           HA       PRO  30   6.524   1.403   3.008
  231    HB2  PRO  30           HB3      PRO  30   5.434   0.365   0.488
  232    HB3  PRO  30           HB2      PRO  30   6.556   1.695   0.804
  233    HG2  PRO  30           HG3      PRO  30   7.447  -0.660  -0.073
  234    HG3  PRO  30           HG2      PRO  30   8.358   0.275   1.126
  235    HD2  PRO  30           HD3      PRO  30   6.776  -2.163   1.382
  236    HD3  PRO  30           HD2      PRO  30   8.175  -1.578   2.305
  237    H    ASN  31           H        ASN  31   4.881   2.444   3.924
  238    HA   ASN  31           HA       ASN  31   2.325   1.460   4.328
  239    HB2  ASN  31           HB3      ASN  31   3.626   3.572   5.292
  240    HB3  ASN  31           HB2      ASN  31   2.666   4.411   4.078
  241   HD21  ASN  31          HD21      ASN  31   2.001   5.339   6.289
  242   HD22  ASN  31          HD22      ASN  31   0.696   4.605   7.000
  243    H    LEU  32           H        LEU  32   3.196   3.997   2.117
  244    HA   LEU  32           HA       LEU  32   1.719   2.949   0.081
  245    HB2  LEU  32           HB3      LEU  32  -0.178   4.458  -0.182
  246    HB3  LEU  32           HB2      LEU  32  -0.214   3.498   1.287
  247    HG   LEU  32           HG       LEU  32  -1.264   5.627   1.850
  248   HD11  LEU  32          HD11      LEU  32   1.400   5.255   2.791
  249   HD12  LEU  32          HD12      LEU  32  -0.027   4.574   3.570
  250   HD13  LEU  32          HD13      LEU  32   0.240   6.316   3.591
  251   HD21  LEU  32          HD21      LEU  32  -0.491   7.589   1.088
  252   HD22  LEU  32          HD22      LEU  32   0.179   6.513  -0.138
  253   HD23  LEU  32          HD23      LEU  32   1.170   7.031   1.232
  254    H    HIS  33           H        HIS  33   3.209   5.656   1.576
  255    HA   HIS  33           HA       HIS  33   3.282   7.588  -0.372
  256    HB2  HIS  33           HB3      HIS  33   4.605   7.122   2.044
  257    HB3  HIS  33           HB2      HIS  33   5.894   7.301   0.860
  258    HD1  HIS  33           HD1      HIS  33   6.544   9.565   2.004
  259    HD2  HIS  33           HD2      HIS  33   2.753   9.493   0.303
  260    HE1  HIS  33           HE1      HIS  33   5.814  11.969   1.886
  261    HE2  HIS  33           HE2      HIS  33   3.484  11.893   0.933
  262    H    GLY  34           H        GLY  34   4.016   7.673  -2.387
  263    HA2  GLY  34           HA3      GLY  34   5.315   7.279  -4.248
  264    HA3  GLY  34           HA2      GLY  34   6.485   6.493  -3.197
  265    H    LEU  35           H        LEU  35   3.297   5.290  -2.977
  266    HA   LEU  35           HA       LEU  35   4.012   2.693  -3.747
  267    HB2  LEU  35           HB3      LEU  35   2.091   3.292  -2.286
  268    HB3  LEU  35           HB2      LEU  35   1.245   3.900  -3.706
  269    HG   LEU  35           HG       LEU  35   1.170   1.670  -4.661
  270   HD11  LEU  35          HD11      LEU  35   2.349  -0.033  -3.886
  271   HD12  LEU  35          HD12      LEU  35   2.211   0.353  -2.235
  272   HD13  LEU  35          HD13      LEU  35   3.402   1.122  -3.282
  273   HD21  LEU  35          HD21      LEU  35   0.292   2.007  -1.853
  274   HD22  LEU  35          HD22      LEU  35  -0.000   0.501  -2.720
  275   HD23  LEU  35          HD23      LEU  35  -0.618   2.021  -3.363
  276    H    PHE  36           H        PHE  36   2.203   5.197  -5.502
  277    HA   PHE  36           HA       PHE  36   2.553   3.626  -7.964
  278    HB2  PHE  36           HB3      PHE  36   0.779   5.925  -7.882
  279    HB3  PHE  36           HB2      PHE  36   0.641   4.387  -8.747
  280    HD1  PHE  36           HD1      PHE  36  -0.382   2.584  -7.693
  281    HD2  PHE  36           HD2      PHE  36   0.153   6.077  -5.526
  282    HE1  PHE  36           HE1      PHE  36  -1.916   1.738  -5.966
  283    HE2  PHE  36           HE2      PHE  36  -1.380   5.246  -3.790
  284    HZ   PHE  36           HZ       PHE  36  -2.423   3.028  -4.029
  285    H    GLY  37           H        GLY  37   4.296   5.722  -6.482
  286    HA2  GLY  37           HA3      GLY  37   4.812   7.370  -8.880
  287    HA3  GLY  37           HA2      GLY  37   4.942   8.013  -7.242
  288    H    ARG  38           H        ARG  38   6.218   5.776  -6.059
  289    HA   ARG  38           HA       ARG  38   8.913   6.218  -7.058
  290    HB2  ARG  38           HB3      ARG  38   7.857   4.850  -4.582
  291    HB3  ARG  38           HB2      ARG  38   9.565   4.948  -4.987
  292    HG2  ARG  38           HG3      ARG  38   9.239   7.472  -5.052
  293    HG3  ARG  38           HG2      ARG  38   7.691   7.171  -4.260
  294    HD2  ARG  38           HD3      ARG  38   8.686   6.927  -2.289
  295    HD3  ARG  38           HD2      ARG  38   9.771   5.700  -2.940
  296    HE   ARG  38           HE       ARG  38  11.381   7.288  -2.692
  297   HH11  ARG  38          HH11      ARG  38   8.448   8.855  -3.725
  298   HH12  ARG  38          HH12      ARG  38   9.176  10.422  -3.850
  299   HH21  ARG  38          HH21      ARG  38  12.350   9.347  -2.851
  300   HH22  ARG  38          HH22      ARG  38  11.394  10.702  -3.353
  301    H    LYS  39           H        LYS  39  10.423   4.268  -7.040
  302    HA   LYS  39           HA       LYS  39   9.656   2.482  -9.008
  303    HB2  LYS  39           HB3      LYS  39  12.004   2.944  -8.422
  304    HB3  LYS  39           HB2      LYS  39  11.797   2.058  -6.918
  305    HG2  LYS  39           HG3      LYS  39  12.757   1.008  -9.239
  306    HG3  LYS  39           HG2      LYS  39  12.078   0.160  -7.873
  307    HD2  LYS  39           HD3      LYS  39  11.096  -0.481 -10.013
  308    HD3  LYS  39           HD2      LYS  39   9.885   0.248  -8.965
  309    HE2  LYS  39           HE3      LYS  39  10.447   2.350 -10.216
  310    HE3  LYS  39           HE2      LYS  39  11.234   1.410 -11.377
  311    HZ1  LYS  39           HZ1      LYS  39   9.256   0.617 -12.100
  312    HZ2  LYS  39           HZ2      LYS  39   8.704   2.113 -11.533
  313    HZ3  LYS  39           HZ3      LYS  39   8.510   0.726 -10.584
  314    H    THR  40           H        THR  40  10.779   0.870  -6.144
  315    HA   THR  40           HA       THR  40   8.203  -0.064  -5.273
  316    HB   THR  40           HB       THR  40   8.702  -2.332  -5.046
  317    HG1  THR  40           HG1      THR  40  10.182  -3.527  -5.950
  318   HG21  THR  40          HG21      THR  40   8.380  -2.090  -7.797
  319   HG22  THR  40          HG22      THR  40   8.666  -2.927  -6.586
  320   HG23  THR  40          HG23      THR  40   7.275  -2.945  -6.283
  321    H    GLY  41           H        GLY  41   8.149   0.387  -3.538
  322    HA2  GLY  41           HA3      GLY  41   8.657   0.433  -1.300
  323    HA3  GLY  41           HA2      GLY  41   9.315  -1.173  -1.566
  324    H    GLN  42           H        GLN  42  10.523   1.837  -2.967
  325    HA   GLN  42           HA       GLN  42  13.091   1.323  -1.642
  326    HB2  GLN  42           HB3      GLN  42  13.572   3.344  -3.426
  327    HB3  GLN  42           HB2      GLN  42  13.818   1.633  -3.745
  328    HG2  GLN  42           HG3      GLN  42  12.570   2.796  -5.523
  329    HG3  GLN  42           HG2      GLN  42  11.675   1.460  -4.802
  330   HE21  GLN  42          HE21      GLN  42   9.611   1.968  -4.802
  331   HE22  GLN  42          HE22      GLN  42   8.932   3.476  -4.304
  332    H    ALA  43           H        ALA  43  11.171   2.372   0.014
  333    HA   ALA  43           HA       ALA  43  10.970   5.129   0.204
  334    HB1  ALA  43           HB1      ALA  43  11.096   4.303   2.835
  335    HB2  ALA  43           HB2      ALA  43  10.559   2.862   1.970
  336    HB3  ALA  43           HB3      ALA  43   9.649   4.367   1.829
  337    HA   PRO  44           HA       PRO  44  14.827   6.625   1.738
  338    HB2  PRO  44           HB3      PRO  44  14.214   8.306   3.732
  339    HB3  PRO  44           HB2      PRO  44  13.700   8.623   2.062
  340    HG2  PRO  44           HG3      PRO  44  12.135   7.481   4.356
  341    HG3  PRO  44           HG2      PRO  44  11.640   8.681   3.149
  342    HD2  PRO  44           HD3      PRO  44  10.995   6.015   3.020
  343    HD3  PRO  44           HD2      PRO  44  11.100   7.081   1.605
  344    H    GLY  45           H        GLY  45  14.008   7.256   4.935
  345    HA2  GLY  45           HA3      GLY  45  16.041   5.536   5.946
  346    HA3  GLY  45           HA2      GLY  45  14.912   6.479   6.905
  347    H    PHE  46           H        PHE  46  13.153   4.616   4.666
  348    HA   PHE  46           HA       PHE  46  12.251   2.837   6.751
  349    HB2  PHE  46           HB3      PHE  46  10.630   3.841   5.213
  350    HB3  PHE  46           HB2      PHE  46  11.419   3.054   3.851
  351    HD1  PHE  46           HD1      PHE  46   9.637   2.363   7.030
  352    HD2  PHE  46           HD2      PHE  46  10.780   0.920   3.189
  353    HE1  PHE  46           HE1      PHE  46   8.189   0.388   7.335
  354    HE2  PHE  46           HE2      PHE  46   9.336  -1.050   3.490
  355    HZ   PHE  46           HZ       PHE  46   8.039  -1.319   5.564
  356    H    THR  47           H        THR  47  12.689   0.709   6.973
  357    HA   THR  47           HA       THR  47  14.847  -0.376   5.434
  358    HB   THR  47           HB       THR  47  13.945  -0.742   8.016
  359    HG1  THR  47           HG1      THR  47  15.643  -2.260   8.113
  360   HG21  THR  47          HG21      THR  47  13.616  -3.213   8.156
  361   HG22  THR  47          HG22      THR  47  13.329  -3.208   6.416
  362   HG23  THR  47          HG23      THR  47  12.253  -2.313   7.491
  363    H    TYR  48           H        TYR  48  14.323  -0.924   3.411
  364    HA   TYR  48           HA       TYR  48  11.813  -2.075   2.698
  365    HB2  TYR  48           HB3      TYR  48  13.723  -2.620   0.756
  366    HB3  TYR  48           HB2      TYR  48  12.453  -1.404   0.773
  367    HD1  TYR  48           HD1      TYR  48  15.908  -1.933   2.012
  368    HD2  TYR  48           HD2      TYR  48  13.064   0.829   0.604
  369    HE1  TYR  48           HE1      TYR  48  17.610  -0.213   2.176
  370    HE2  TYR  48           HE2      TYR  48  14.767   2.596   0.681
  371    HH   TYR  48           HH       TYR  48  17.882   2.092   2.167
  372    H    THR  49           H        THR  49  11.587  -4.120   1.712
  373    HA   THR  49           HA       THR  49  12.867  -6.257   3.167
  374    HB   THR  49           HB       THR  49  11.260  -7.704   2.105
  375    HG1  THR  49           HG1      THR  49   9.811  -6.659   0.510
  376   HG21  THR  49          HG21      THR  49   9.354  -5.543   2.255
  377   HG22  THR  49          HG22      THR  49  10.466  -5.538   3.624
  378   HG23  THR  49          HG23      THR  49   9.520  -6.981   3.262
  379    H    ASP  50           H        ASP  50  13.530  -8.260   1.794
  380    HA   ASP  50           HA       ASP  50  15.790  -7.611   0.330
  381    HB2  ASP  50           HB3      ASP  50  15.831  -9.811   1.021
  382    HB3  ASP  50           HB2      ASP  50  14.137 -10.077   0.622
  383    H    ALA  51           H        ALA  51  12.455  -8.060  -0.742
  384    HA   ALA  51           HA       ALA  51  13.005  -8.061  -3.481
  385    HB1  ALA  51           HB1      ALA  51  10.882  -8.698  -3.578
  386    HB2  ALA  51           HB2      ALA  51  10.358  -7.136  -2.949
  387    HB3  ALA  51           HB3      ALA  51  10.743  -8.451  -1.838
  388    H    ASN  52           H        ASN  52  11.916  -5.578  -1.180
  389    HA   ASN  52           HA       ASN  52  11.591  -3.495  -3.030
  390    HB2  ASN  52           HB3      ASN  52  12.328  -3.381  -0.099
  391    HB3  ASN  52           HB2      ASN  52  11.823  -2.042  -1.085
  392   HD21  ASN  52          HD21      ASN  52  10.038  -4.089  -2.487
  393   HD22  ASN  52          HD22      ASN  52   8.640  -4.137  -1.473
  394    H    LYS  53           H        LYS  53  14.399  -4.472  -1.103
  395    HA   LYS  53           HA       LYS  53  16.115  -2.457  -1.884
  396    HB2  LYS  53           HB3      LYS  53  17.949  -4.089  -1.327
  397    HB3  LYS  53           HB2      LYS  53  16.781  -3.826  -0.067
  398    HG2  LYS  53           HG3      LYS  53  15.659  -5.829  -0.452
  399    HG3  LYS  53           HG2      LYS  53  16.596  -6.112  -1.921
  400    HD2  LYS  53           HD3      LYS  53  17.753  -7.433  -0.480
  401    HD3  LYS  53           HD2      LYS  53  18.627  -5.926  -0.241
  402    HE2  LYS  53           HE3      LYS  53  18.134  -5.943   1.865
  403    HE3  LYS  53           HE2      LYS  53  16.421  -5.853   1.461
  404    HZ1  LYS  53           HZ1      LYS  53  17.940  -8.067   2.436
  405    HZ2  LYS  53           HZ2      LYS  53  17.084  -8.467   1.033
  406    HZ3  LYS  53           HZ3      LYS  53  16.262  -7.854   2.380
  407    H    ASN  54           H        ASN  54  15.146  -5.332  -3.471
  408    HA   ASN  54           HA       ASN  54  17.173  -5.230  -5.499
  409    HB2  ASN  54           HB3      ASN  54  14.543  -6.729  -5.445
  410    HB3  ASN  54           HB2      ASN  54  15.848  -6.993  -6.597
  411   HD21  ASN  54          HD21      ASN  54  17.219  -6.211  -3.714
  412   HD22  ASN  54          HD22      ASN  54  17.501  -7.798  -3.089
  413    H    LYS  55           H        LYS  55  14.246  -3.615  -4.913
  414    HA   LYS  55           HA       LYS  55  13.204  -1.936  -6.052
  415    HB2  LYS  55           HB3      LYS  55  15.489  -2.411  -7.954
  416    HB3  LYS  55           HB2      LYS  55  14.214  -1.253  -8.308
  417    HG2  LYS  55           HG3      LYS  55  15.024   0.210  -6.916
  418    HG3  LYS  55           HG2      LYS  55  15.370  -0.995  -5.674
  419    HD2  LYS  55           HD3      LYS  55  17.057  -0.199  -8.032
  420    HD3  LYS  55           HD2      LYS  55  17.468  -0.132  -6.316
  421    HE2  LYS  55           HE3      LYS  55  17.093  -2.663  -6.408
  422    HE3  LYS  55           HE2      LYS  55  17.377  -2.426  -8.132
  423    HZ1  LYS  55           HZ1      LYS  55  19.464  -2.893  -7.248
  424    HZ2  LYS  55           HZ2      LYS  55  19.224  -1.926  -5.881
  425    HZ3  LYS  55           HZ3      LYS  55  19.467  -1.207  -7.393
  426    H    GLY  56           H        GLY  56  11.778  -4.011  -6.110
  427    HA2  GLY  56           HA3      GLY  56  11.342  -5.524  -8.390
  428    HA3  GLY  56           HA2      GLY  56  10.097  -5.102  -7.226
  429    H    ILE  57           H        ILE  57   8.483  -3.719  -7.797
  430    HA   ILE  57           HA       ILE  57   8.950  -1.919 -10.017
  431    HB   ILE  57           HB       ILE  57   7.808  -4.338 -10.587
  432   HG12  ILE  57          HG13      ILE  57   8.667  -3.221 -12.364
  433   HG13  ILE  57          HG12      ILE  57   6.962  -2.880 -12.642
  434   HG21  ILE  57          HG21      ILE  57   5.731  -3.982  -9.565
  435   HG22  ILE  57          HG22      ILE  57   5.465  -3.626 -11.271
  436   HG23  ILE  57          HG23      ILE  57   5.658  -2.309 -10.116
  437   HD11  ILE  57          HD11      ILE  57   7.184  -0.697 -12.119
  438   HD12  ILE  57          HD12      ILE  57   8.842  -1.001 -12.641
  439   HD13  ILE  57          HD13      ILE  57   8.443  -1.000 -10.921
  440    H    THR  58           H        THR  58   6.949  -0.575 -10.472
  441    HA   THR  58           HA       THR  58   6.091   0.538  -7.945
  442    HB   THR  58           HB       THR  58   6.514   1.534 -10.534
  443    HG1  THR  58           HG1      THR  58   6.024   3.474  -9.510
  444   HG21  THR  58          HG21      THR  58   4.155   0.995 -11.049
  445   HG22  THR  58          HG22      THR  58   4.517   2.720 -11.100
  446   HG23  THR  58          HG23      THR  58   3.666   2.040  -9.714
  447    H    TRP  59           H        TRP  59   4.435  -0.228  -6.904
  448    HA   TRP  59           HA       TRP  59   2.480  -1.950  -8.005
  449    HB2  TRP  59           HB3      TRP  59   1.821  -0.525  -5.498
  450    HB3  TRP  59           HB2      TRP  59   1.812  -2.251  -5.852
  451    HD1  TRP  59           HD1      TRP  59   4.250   0.514  -4.907
  452    HE1  TRP  59           HE1      TRP  59   6.319  -0.502  -3.769
  453    HE3  TRP  59           HE3      TRP  59   3.102  -4.363  -5.588
  454    HZ2  TRP  59           HZ2      TRP  59   7.320  -3.089  -3.254
  455    HZ3  TRP  59           HZ3      TRP  59   4.665  -6.073  -4.754
  456    HH2  TRP  59           HH2      TRP  59   6.730  -5.447  -3.612
  457    H    LYS  60           H        LYS  60   1.083  -1.312  -9.498
  458    HA   LYS  60           HA       LYS  60  -0.144   1.340  -9.221
  459    HB2  LYS  60           HB3      LYS  60   0.170   1.460 -11.430
  460    HB3  LYS  60           HB2      LYS  60   0.775  -0.189 -11.460
  461    HG2  LYS  60           HG3      LYS  60  -0.965  -0.526 -12.831
  462    HG3  LYS  60           HG2      LYS  60  -1.878  -0.657 -11.328
  463    HD2  LYS  60           HD3      LYS  60  -2.995   1.249 -11.713
  464    HD3  LYS  60           HD2      LYS  60  -1.543   2.093 -12.259
  465    HE2  LYS  60           HE3      LYS  60  -2.210   0.149 -14.213
  466    HE3  LYS  60           HE2      LYS  60  -3.682   1.031 -13.808
  467    HZ1  LYS  60           HZ1      LYS  60  -1.769   1.861 -15.539
  468    HZ2  LYS  60           HZ2      LYS  60  -1.400   2.737 -14.142
  469    HZ3  LYS  60           HZ3      LYS  60  -2.940   2.852 -14.827
  470    H    GLU  61           H        GLU  61  -2.468   1.398 -10.037
  471    HA   GLU  61           HA       GLU  61  -4.072  -0.115  -8.269
  472    HB2  GLU  61           HB3      GLU  61  -4.471   2.056  -9.945
  473    HB3  GLU  61           HB2      GLU  61  -5.534   0.823 -10.611
  474    HG2  GLU  61           HG3      GLU  61  -5.806   0.842  -7.775
  475    HG3  GLU  61           HG2      GLU  61  -5.964   2.490  -8.381
  476    H    GLU  62           H        GLU  62  -3.878  -0.384 -11.825
  477    HA   GLU  62           HA       GLU  62  -5.464  -2.697 -12.018
  478    HB2  GLU  62           HB3      GLU  62  -4.990  -2.664 -14.268
  479    HB3  GLU  62           HB2      GLU  62  -4.626  -1.000 -13.837
  480    HG2  GLU  62           HG3      GLU  62  -2.239  -1.620 -13.641
  481    HG3  GLU  62           HG2      GLU  62  -2.650  -3.238 -14.206
  482    H    THR  63           H        THR  63  -1.917  -2.282 -11.774
  483    HA   THR  63           HA       THR  63  -1.246  -4.995 -12.120
  484    HB   THR  63           HB       THR  63   0.071  -2.565 -11.663
  485    HG1  THR  63           HG1      THR  63   1.384  -3.627 -12.885
  486   HG21  THR  63          HG21      THR  63   1.582  -2.880  -9.966
  487   HG22  THR  63          HG22      THR  63   1.288  -4.618  -9.880
  488   HG23  THR  63          HG23      THR  63   0.096  -3.489  -9.239
  489    H    LEU  64           H        LEU  64  -2.345  -3.171  -9.383
  490    HA   LEU  64           HA       LEU  64  -1.578  -5.044  -7.378
  491    HB2  LEU  64           HB3      LEU  64  -3.047  -2.529  -7.532
  492    HB3  LEU  64           HB2      LEU  64  -3.737  -3.641  -6.363
  493    HG   LEU  64           HG       LEU  64  -0.893  -2.631  -6.397
  494   HD11  LEU  64          HD11      LEU  64  -1.975  -0.870  -5.473
  495   HD12  LEU  64          HD12      LEU  64  -1.875  -1.882  -4.032
  496   HD13  LEU  64          HD13      LEU  64  -3.362  -1.840  -4.977
  497   HD21  LEU  64          HD21      LEU  64  -0.578  -3.858  -4.348
  498   HD22  LEU  64          HD22      LEU  64  -1.091  -4.971  -5.615
  499   HD23  LEU  64          HD23      LEU  64  -2.244  -4.436  -4.395
  500    H    MET  65           H        MET  65  -4.410  -4.558  -9.389
  501    HA   MET  65           HA       MET  65  -6.202  -6.244  -8.046
  502    HB2  MET  65           HB3      MET  65  -5.960  -5.466 -10.950
  503    HB3  MET  65           HB2      MET  65  -7.265  -6.481 -10.354
  504    HG2  MET  65           HG3      MET  65  -6.670  -3.637  -9.609
  505    HG3  MET  65           HG2      MET  65  -8.085  -4.263 -10.467
  506    HE1  MET  65           HE1      MET  65  -6.569  -3.132  -7.286
  507    HE2  MET  65           HE2      MET  65  -6.113  -4.811  -6.992
  508    HE3  MET  65           HE3      MET  65  -7.341  -4.039  -5.986
  509    H    GLU  66           H        GLU  66  -3.795  -6.918 -10.568
  510    HA   GLU  66           HA       GLU  66  -4.462  -9.715 -10.688
  511    HB2  GLU  66           HB3      GLU  66  -2.242  -9.760 -12.013
  512    HB3  GLU  66           HB2      GLU  66  -3.611  -8.900 -12.706
  513    HG2  GLU  66           HG3      GLU  66  -2.699  -6.786 -11.989
  514    HG3  GLU  66           HG2      GLU  66  -1.369  -7.607 -11.168
  515    H    TYR  67           H        TYR  67  -2.047  -7.699  -9.130
  516    HA   TYR  67           HA       TYR  67  -0.388  -9.711  -8.216
  517    HB2  TYR  67           HB3      TYR  67   0.605  -7.675  -7.930
  518    HB3  TYR  67           HB2      TYR  67  -0.911  -6.889  -7.570
  519    HD1  TYR  67           HD1      TYR  67   2.010  -8.597  -6.221
  520    HD2  TYR  67           HD2      TYR  67  -1.733  -6.977  -5.226
  521    HE1  TYR  67           HE1      TYR  67   2.620  -8.642  -3.839
  522    HE2  TYR  67           HE2      TYR  67  -1.133  -7.015  -2.841
  523    HH   TYR  67           HH       TYR  67   0.653  -7.104  -1.462
  524    H    LEU  68           H        LEU  68  -3.452  -8.711  -7.169
  525    HA   LEU  68           HA       LEU  68  -3.392  -9.550  -4.491
  526    HB2  LEU  68           HB3      LEU  68  -5.587  -9.222  -6.509
  527    HB3  LEU  68           HB2      LEU  68  -5.929  -9.878  -4.919
  528    HG   LEU  68           HG       LEU  68  -4.651  -7.185  -5.390
  529   HD11  LEU  68          HD11      LEU  68  -6.772  -6.189  -4.981
  530   HD12  LEU  68          HD12      LEU  68  -7.505  -7.752  -4.615
  531   HD13  LEU  68          HD13      LEU  68  -6.990  -7.382  -6.261
  532   HD21  LEU  68          HD21      LEU  68  -4.106  -8.126  -3.259
  533   HD22  LEU  68          HD22      LEU  68  -5.448  -7.213  -2.644
  534   HD23  LEU  68          HD23      LEU  68  -5.255  -6.815  -3.030
  535    H    GLU  69           H        GLU  69  -3.289 -11.336  -7.378
  536    HA   GLU  69           HA       GLU  69  -4.616 -13.696  -6.650
  537    HB2  GLU  69           HB3      GLU  69  -3.259 -12.810  -8.871
  538    HB3  GLU  69           HB2      GLU  69  -2.268 -14.079  -8.277
  539    HG2  GLU  69           HG3      GLU  69  -4.064 -15.660  -8.337
  540    HG3  GLU  69           HG2      GLU  69  -5.142 -14.379  -8.889
  541    H    ASN  70           H        ASN  70  -1.133 -13.590  -7.001
  542    HA   ASN  70           HA       ASN  70  -0.938 -15.084  -4.541
  543    HB2  ASN  70           HB3      ASN  70   0.438 -15.436  -7.123
  544    HB3  ASN  70           HB2      ASN  70   1.282 -15.886  -5.702
  545   HD21  ASN  70          HD21      ASN  70  -1.085 -16.734  -7.952
  546   HD22  ASN  70          HD22      ASN  70  -1.601 -18.192  -7.289
  547    HA   PRO  71           HA       PRO  71   1.105 -11.091  -3.567
  548    HB2  PRO  71           HB3      PRO  71   1.110 -12.545  -0.962
  549    HB3  PRO  71           HB2      PRO  71   0.682 -10.866  -1.313
  550    HG2  PRO  71           HG3      PRO  71  -1.210 -12.675  -0.840
  551    HG3  PRO  71           HG2      PRO  71  -1.434 -11.424  -2.077
  552    HD2  PRO  71           HD3      PRO  71  -0.810 -14.323  -2.400
  553    HD3  PRO  71           HD2      PRO  71  -1.797 -13.258  -3.423
  554    H    LYS  72           H        LYS  72   2.044 -14.391  -2.790
  555    HA   LYS  72           HA       LYS  72   4.767 -13.688  -2.176
  556    HB2  LYS  72           HB3      LYS  72   4.766 -15.700  -1.213
  557    HB3  LYS  72           HB2      LYS  72   3.112 -15.930  -1.761
  558    HG2  LYS  72           HG3      LYS  72   4.101 -17.779  -2.653
  559    HG3  LYS  72           HG2      LYS  72   4.291 -16.649  -3.994
  560    HD2  LYS  72           HD3      LYS  72   6.498 -16.357  -2.203
  561    HD3  LYS  72           HD2      LYS  72   6.302 -18.065  -2.605
  562    HE2  LYS  72           HE3      LYS  72   5.953 -16.633  -5.001
  563    HE3  LYS  72           HE2      LYS  72   7.360 -15.931  -4.203
  564    HZ1  LYS  72           HZ1      LYS  72   8.336 -18.124  -4.042
  565    HZ2  LYS  72           HZ2      LYS  72   7.958 -17.780  -5.655
  566    HZ3  LYS  72           HZ3      LYS  72   6.973 -18.823  -4.761
  567    H    LYS  73           H        LYS  73   2.954 -14.530  -4.984
  568    HA   LYS  73           HA       LYS  73   5.096 -15.510  -6.520
  569    HB2  LYS  73           HB3      LYS  73   3.574 -15.613  -8.263
  570    HB3  LYS  73           HB2      LYS  73   2.509 -15.705  -6.867
  571    HG2  LYS  73           HG3      LYS  73   1.379 -14.114  -7.983
  572    HG3  LYS  73           HG2      LYS  73   2.559 -13.045  -7.220
  573    HD2  LYS  73           HD3      LYS  73   2.168 -12.791  -9.742
  574    HD3  LYS  73           HD2      LYS  73   3.837 -12.875  -9.173
  575    HE2  LYS  73           HE3      LYS  73   3.295 -14.266 -11.207
  576    HE3  LYS  73           HE2      LYS  73   4.062 -15.123  -9.870
  577    HZ1  LYS  73           HZ1      LYS  73   1.728 -15.752  -9.185
  578    HZ2  LYS  73           HZ2      LYS  73   2.319 -16.491 -10.589
  579    HZ3  LYS  73           HZ3      LYS  73   1.223 -15.206 -10.705
  580    H    TYR  74           H        TYR  74   3.840 -12.342  -5.768
  581    HA   TYR  74           HA       TYR  74   5.327 -11.017  -7.856
  582    HB2  TYR  74           HB3      TYR  74   3.403 -10.220  -5.755
  583    HB3  TYR  74           HB2      TYR  74   4.591  -9.001  -6.206
  584    HD1  TYR  74           HD1      TYR  74   2.076 -11.317  -7.689
  585    HD2  TYR  74           HD2      TYR  74   4.225  -7.667  -8.078
  586    HE1  TYR  74           HE1      TYR  74   0.724 -10.738  -9.660
  587    HE2  TYR  74           HE2      TYR  74   2.877  -7.076 -10.049
  588    HH   TYR  74           HH       TYR  74   0.625  -9.345 -11.481
  589    H    ILE  75           H        ILE  75   5.573 -11.360  -4.331
  590    HA   ILE  75           HA       ILE  75   8.398 -10.587  -4.541
  591    HB   ILE  75           HB       ILE  75   6.404  -9.576  -2.572
  592   HG12  ILE  75          HG13      ILE  75   6.454  -8.090  -4.294
  593   HG13  ILE  75          HG12      ILE  75   7.638  -7.412  -3.181
  594   HG21  ILE  75          HG21      ILE  75   8.428  -8.511  -1.476
  595   HG22  ILE  75          HG22      ILE  75   9.403  -9.654  -2.399
  596   HG23  ILE  75          HG23      ILE  75   8.221 -10.244  -1.231
  597   HD11  ILE  75          HD11      ILE  75   8.941  -7.317  -4.990
  598   HD12  ILE  75          HD12      ILE  75   7.986  -8.516  -5.865
  599   HD13  ILE  75          HD13      ILE  75   9.197  -9.036  -4.692
  600    HA   PRO  76           HA       PRO  76   7.918 -14.743  -2.610
  601    HB2  PRO  76           HB3      PRO  76  10.611 -14.974  -3.800
  602    HB3  PRO  76           HB2      PRO  76   9.262 -16.098  -3.877
  603    HG2  PRO  76           HG3      PRO  76   9.907 -14.671  -5.966
  604    HG3  PRO  76           HG2      PRO  76   8.213 -15.008  -5.566
  605    HD2  PRO  76           HD3      PRO  76   9.796 -12.505  -5.159
  606    HD3  PRO  76           HD2      PRO  76   8.103 -12.700  -5.659
  607    H    GLY  77           H        GLY  77   8.575 -15.154  -0.587
  608    HA2  GLY  77           HA3      GLY  77  10.333 -15.361   1.050
  609    HA3  GLY  77           HA2      GLY  77  11.098 -13.949   0.340
  610    H    THR  78           H        THR  78   8.229 -12.782   0.229
  611    HA   THR  78           HA       THR  78   8.340 -11.698   2.951
  612    HB   THR  78           HB       THR  78   8.143 -10.430   0.518
  613    HG1  THR  78           HG1      THR  78   7.180  -9.406   2.977
  614   HG21  THR  78          HG21      THR  78   5.705 -11.221   0.496
  615   HG22  THR  78          HG22      THR  78   6.040  -9.517   0.189
  616   HG23  THR  78          HG23      THR  78   5.460 -10.031   1.773
  617    H    LYS  79           H        LYS  79   6.832 -12.157   4.409
  618    HA   LYS  79           HA       LYS  79   4.419 -13.578   3.511
  619    HB2  LYS  79           HB3      LYS  79   6.149 -14.583   5.195
  620    HB3  LYS  79           HB2      LYS  79   5.351 -13.534   6.359
  621    HG2  LYS  79           HG3      LYS  79   4.569 -15.988   6.086
  622    HG3  LYS  79           HG2      LYS  79   3.373 -14.703   6.267
  623    HD2  LYS  79           HD3      LYS  79   2.827 -16.335   4.469
  624    HD3  LYS  79           HD2      LYS  79   2.966 -14.669   3.900
  625    HE2  LYS  79           HE3      LYS  79   4.065 -16.326   2.411
  626    HE3  LYS  79           HE2      LYS  79   5.160 -15.088   3.024
  627    HZ1  LYS  79           HZ1      LYS  79   6.071 -17.370   3.093
  628    HZ2  LYS  79           HZ2      LYS  79   4.884 -17.789   4.222
  629    HZ3  LYS  79           HZ3      LYS  79   6.045 -16.619   4.601
  630    H    MET  80           H        MET  80   2.513 -13.001   4.113
  631    HA   MET  80           HA       MET  80   2.343 -10.339   5.397
  632    HB2  MET  80           HB3      MET  80   0.646 -11.748   3.364
  633    HB3  MET  80           HB2      MET  80  -0.085 -10.511   4.379
  634    HG2  MET  80           HG3      MET  80   2.427  -9.983   2.838
  635    HG3  MET  80           HG2      MET  80   0.836  -9.821   2.098
  636    HE1  MET  80           HE1      MET  80  -0.453  -8.220   2.043
  637    HE2  MET  80           HE2      MET  80   0.105  -6.571   2.323
  638    HE3  MET  80           HE3      MET  80  -0.999  -7.334   3.467
  639    H    ILE  81           H        ILE  81   1.926 -10.311   7.295
  640    HA   ILE  81           HA       ILE  81   0.283 -12.356   8.627
  641    HB   ILE  81           HB       ILE  81   2.374 -10.514   9.792
  642   HG12  ILE  81          HG13      ILE  81   3.291 -12.975  10.300
  643   HG13  ILE  81          HG12      ILE  81   2.377 -13.333   8.838
  644   HG21  ILE  81          HG21      ILE  81   1.351 -12.784  11.363
  645   HG22  ILE  81          HG22      ILE  81   0.227 -11.444  11.129
  646   HG23  ILE  81          HG23      ILE  81   1.769 -11.161  11.869
  647   HD11  ILE  81          HD11      ILE  81   4.428 -12.866   7.962
  648   HD12  ILE  81          HD12      ILE  81   4.804 -11.674   9.217
  649   HD13  ILE  81          HD13      ILE  81   3.683 -11.267   7.897
  650    H    PHE  82           H        PHE  82  -1.543 -11.882   9.600
  651    HA   PHE  82           HA       PHE  82  -2.994 -10.606  10.725
  652    HB2  PHE  82           HB3      PHE  82  -1.007  -9.110  11.290
  653    HB3  PHE  82           HB2      PHE  82  -1.586  -8.077  10.032
  654    HD1  PHE  82           HD1      PHE  82  -2.151  -9.468  13.358
  655    HD2  PHE  82           HD2      PHE  82  -3.551  -6.817  10.339
  656    HE1  PHE  82           HE1      PHE  82  -3.703  -8.453  14.976
  657    HE2  PHE  82           HE2      PHE  82  -5.122  -5.885  11.907
  658    HZ   PHE  82           HZ       PHE  82  -5.228  -6.697  14.229
  659    H    ALA  83           H        ALA  83  -4.660  -8.959  10.113
  660    HA   ALA  83           HA       ALA  83  -5.193  -7.515   8.037
  661    HB1  ALA  83           HB1      ALA  83  -5.907  -9.283   6.212
  662    HB2  ALA  83           HB2      ALA  83  -4.619 -10.216   6.971
  663    HB3  ALA  83           HB3      ALA  83  -4.271  -8.629   6.285
  664    H    GLY  84           H        GLY  84  -6.893  -7.089   9.480
  665    HA2  GLY  84           HA3      GLY  84  -8.909  -9.086   9.985
  666    HA3  GLY  84           HA2      GLY  84  -8.951  -7.407  10.501
  667    H    ILE  85           H        ILE  85  -8.356  -7.887   7.219
  668    HA   ILE  85           HA       ILE  85 -11.190  -7.540   6.512
  669    HB   ILE  85           HB       ILE  85  -8.898  -5.906   5.423
  670   HG12  ILE  85          HG13      ILE  85 -10.434  -5.514   7.713
  671   HG13  ILE  85          HG12      ILE  85  -9.461  -4.301   6.887
  672   HG21  ILE  85          HG21      ILE  85 -11.820  -5.852   4.684
  673   HG22  ILE  85          HG22      ILE  85 -10.513  -6.487   3.684
  674   HG23  ILE  85          HG23      ILE  85 -10.574  -4.766   4.069
  675   HD11  ILE  85          HD11      ILE  85 -11.588  -3.990   5.426
  676   HD12  ILE  85          HD12      ILE  85 -11.499  -3.261   7.029
  677   HD13  ILE  85          HD13      ILE  85 -12.400  -4.757   6.789
  678    H    LYS  86           H        LYS  86 -11.808  -8.334   4.500
  679    HA   LYS  86           HA       LYS  86  -9.819  -9.568   2.783
  680    HB2  LYS  86           HB3      LYS  86 -11.425 -11.679   2.832
  681    HB3  LYS  86           HB2      LYS  86 -10.084 -11.515   3.955
  682    HG2  LYS  86           HG3      LYS  86 -12.357 -10.233   5.083
  683    HG3  LYS  86           HG2      LYS  86 -12.830 -11.840   4.530
  684    HD2  LYS  86           HD3      LYS  86 -11.363 -12.908   5.956
  685    HD3  LYS  86           HD2      LYS  86 -10.295 -11.510   6.072
  686    HE2  LYS  86           HE3      LYS  86 -12.401 -10.414   7.206
  687    HE3  LYS  86           HE2      LYS  86 -12.832 -12.095   7.521
  688    HZ1  LYS  86           HZ1      LYS  86 -10.158 -11.050   8.213
  689    HZ2  LYS  86           HZ2      LYS  86 -10.953 -12.411   8.827
  690    HZ3  LYS  86           HZ3      LYS  86 -11.468 -10.859   9.268
  691    H    LYS  87           H        LYS  87 -13.209  -8.903   3.455
  692    HA   LYS  87           HA       LYS  87 -14.543  -9.486   1.218
  693    HB2  LYS  87           HB3      LYS  87 -14.864  -7.627   3.291
  694    HB3  LYS  87           HB2      LYS  87 -15.056  -6.705   1.806
  695    HG2  LYS  87           HG3      LYS  87 -17.144  -7.429   1.689
  696    HG3  LYS  87           HG2      LYS  87 -16.525  -9.064   1.446
  697    HD2  LYS  87           HD3      LYS  87 -16.357  -9.215   3.977
  698    HD3  LYS  87           HD2      LYS  87 -17.321  -7.737   4.026
  699    HE2  LYS  87           HE3      LYS  87 -18.640  -9.849   4.255
  700    HE3  LYS  87           HE2      LYS  87 -19.150  -8.804   2.928
  701    HZ1  LYS  87           HZ1      LYS  87 -18.860 -11.329   2.535
  702    HZ2  LYS  87           HZ2      LYS  87 -17.213 -10.959   2.421
  703    HZ3  LYS  87           HZ3      LYS  87 -18.317 -10.241   1.360
  704    H    LYS  88           H        LYS  88 -14.069  -9.331  -0.868
  705    HA   LYS  88           HA       LYS  88 -12.023  -7.897  -2.013
  706    HB2  LYS  88           HB3      LYS  88 -13.180  -9.689  -3.187
  707    HB3  LYS  88           HB2      LYS  88 -14.645  -8.718  -3.272
  708    HG2  LYS  88           HG3      LYS  88 -13.655  -7.199  -4.797
  709    HG3  LYS  88           HG2      LYS  88 -12.049  -7.886  -4.539
  710    HD2  LYS  88           HD3      LYS  88 -14.260  -8.822  -6.242
  711    HD3  LYS  88           HD2      LYS  88 -12.518  -9.012  -6.438
  712    HE2  LYS  88           HE3      LYS  88 -13.475 -11.179  -6.089
  713    HE3  LYS  88           HE2      LYS  88 -12.571 -10.736  -4.642
  714    HZ1  LYS  88           HZ1      LYS  88 -15.210 -11.531  -4.782
  715    HZ2  LYS  88           HZ2      LYS  88 -15.260  -9.877  -4.431
  716    HZ3  LYS  88           HZ3      LYS  88 -14.396 -10.926  -3.427
  717    H    THR  89           H        THR  89 -15.346  -6.888  -1.435
  718    HA   THR  89           HA       THR  89 -15.189  -4.447  -2.873
  719    HB   THR  89           HB       THR  89 -17.325  -4.021  -2.103
  720    HG1  THR  89           HG1      THR  89 -17.217  -3.822   0.021
  721   HG21  THR  89          HG21      THR  89 -17.199  -6.959  -1.498
  722   HG22  THR  89          HG22      THR  89 -17.251  -6.292  -3.131
  723   HG23  THR  89          HG23      THR  89 -18.597  -6.020  -2.023
  724    H    GLU  90           H        GLU  90 -14.276  -5.348   0.345
  725    HA   GLU  90           HA       GLU  90 -14.048  -2.694   1.391
  726    HB2  GLU  90           HB3      GLU  90 -12.798  -5.247   2.422
  727    HB3  GLU  90           HB2      GLU  90 -13.001  -3.749   3.320
  728    HG2  GLU  90           HG3      GLU  90 -15.461  -4.904   2.194
  729    HG3  GLU  90           HG2      GLU  90 -14.683  -5.840   3.470
  730    H    ARG  91           H        ARG  91 -11.827  -5.183   0.243
  731    HA   ARG  91           HA       ARG  91  -9.472  -3.698   0.627
  732    HB2  ARG  91           HB3      ARG  91  -9.991  -5.921  -1.290
  733    HB3  ARG  91           HB2      ARG  91  -8.451  -5.080  -1.171
  734    HG2  ARG  91           HG3      ARG  91  -8.882  -5.692   1.424
  735    HG3  ARG  91           HG2      ARG  91  -9.677  -7.061   0.622
  736    HD2  ARG  91           HD3      ARG  91  -7.039  -6.869  -0.670
  737    HD3  ARG  91           HD2      ARG  91  -6.931  -6.590   1.066
  738    HE   ARG  91           HE       ARG  91  -8.252  -8.713   1.112
  739   HH11  ARG  91          HH11      ARG  91  -5.872  -7.773  -1.250
  740   HH12  ARG  91          HH12      ARG  91  -5.334  -9.324  -1.523
  741   HH21  ARG  91          HH21      ARG  91  -7.569 -10.854   0.716
  742   HH22  ARG  91          HH22      ARG  91  -6.313 -11.156  -0.423
  743    H    GLU  92           H        GLU  92 -11.423  -4.114  -2.213
  744    HA   GLU  92           HA       GLU  92  -9.946  -2.455  -3.906
  745    HB2  GLU  92           HB3      GLU  92 -11.796  -4.053  -4.555
  746    HB3  GLU  92           HB2      GLU  92 -12.940  -2.830  -4.015
  747    HG2  GLU  92           HG3      GLU  92 -12.696  -2.700  -6.395
  748    HG3  GLU  92           HG2      GLU  92 -11.992  -1.260  -5.660
  749    H    ASP  93           H        ASP  93 -12.615  -1.729  -1.719
  750    HA   ASP  93           HA       ASP  93 -13.075   0.926  -2.468
  751    HB2  ASP  93           HB3      ASP  93 -14.638  -0.063  -0.989
  752    HB3  ASP  93           HB2      ASP  93 -13.383  -0.523   0.157
  753    H    GLY  94           H        GLY  94 -10.770  -0.368  -0.085
  754    HA2  GLY  94           HA3      GLY  94  -9.736   1.964   0.809
  755    HA3  GLY  94           HA2      GLY  94  -8.899   0.422   0.836
  756    H    ILE  95           H        ILE  95  -8.905   0.061  -1.874
  757    HA   ILE  95           HA       ILE  95  -6.509   1.281  -2.582
  758    HB   ILE  95           HB       ILE  95  -8.477  -0.368  -3.967
  759   HG12  ILE  95          HG13      ILE  95  -5.480  -0.345  -3.628
  760   HG13  ILE  95          HG12      ILE  95  -6.639  -1.406  -2.833
  761   HG21  ILE  95          HG21      ILE  95  -8.334   0.693  -5.918
  762   HG22  ILE  95          HG22      ILE  95  -6.649   0.179  -5.967
  763   HG23  ILE  95          HG23      ILE  95  -7.067   1.768  -5.328
  764   HD11  ILE  95          HD11      ILE  95  -6.310  -1.388  -5.806
  765   HD12  ILE  95          HD12      ILE  95  -7.021  -2.628  -4.774
  766   HD13  ILE  95          HD13      ILE  95  -5.279  -2.356  -4.751
  767    H    ALA  96           H        ALA  96  -9.864   2.115  -3.333
  768    HA   ALA  96           HA       ALA  96  -9.429   4.016  -5.284
  769    HB1  ALA  96           HB1      ALA  96 -11.637   3.253  -4.818
  770    HB2  ALA  96           HB2      ALA  96 -11.638   4.909  -4.607
  771    HB3  ALA  96           HB3      ALA  96 -11.626   3.816  -3.222
  772    H    TYR  97           H        TYR  97  -9.696   4.247  -1.753
  773    HA   TYR  97           HA       TYR  97  -9.278   7.017  -1.543
  774    HB2  TYR  97           HB3      TYR  97 -10.101   5.892   0.381
  775    HB3  TYR  97           HB2      TYR  97  -8.781   4.730   0.363
  776    HD1  TYR  97           HD1      TYR  97  -7.832   5.049   2.440
  777    HD2  TYR  97           HD2      TYR  97  -8.545   8.424   0.036
  778    HE1  TYR  97           HE1      TYR  97  -6.575   6.465   3.990
  779    HE2  TYR  97           HE2      TYR  97  -7.294   9.833   1.615
  780    HH   TYR  97           HH       TYR  97  -5.483   8.473   4.255
  781    H    LEU  98           H        LEU  98  -7.083   4.288  -1.738
  782    HA   LEU  98           HA       LEU  98  -4.682   5.629  -1.148
  783    HB2  LEU  98           HB3      LEU  98  -5.452   3.038  -1.815
  784    HB3  LEU  98           HB2      LEU  98  -4.393   3.519  -3.125
  785    HG   LEU  98           HG       LEU  98  -3.614   3.714  -0.220
  786   HD11  LEU  98          HD11      LEU  98  -2.142   1.674  -1.322
  787   HD12  LEU  98          HD12      LEU  98  -3.751   1.412  -2.009
  788   HD13  LEU  98          HD13      LEU  98  -3.525   1.483  -0.245
  789   HD21  LEU  98          HD21      LEU  98  -2.112   3.940  -2.818
  790   HD22  LEU  98          HD22      LEU  98  -1.320   3.720  -1.258
  791   HD23  LEU  98          HD23      LEU  98  -2.293   5.160  -1.558
  792    H    LYS  99           H        LYS  99  -6.530   5.261  -4.109
  793    HA   LYS  99           HA       LYS  99  -4.620   6.117  -5.957
  794    HB2  LYS  99           HB3      LYS  99  -7.574   6.712  -6.131
  795    HB3  LYS  99           HB2      LYS  99  -6.438   6.511  -7.459
  796    HG2  LYS  99           HG3      LYS  99  -7.385   4.369  -5.568
  797    HG3  LYS  99           HG2      LYS  99  -7.837   4.561  -7.263
  798    HD2  LYS  99           HD3      LYS  99  -6.137   2.879  -6.579
  799    HD3  LYS  99           HD2      LYS  99  -5.211   4.454  -7.593
  800    HE2  LYS  99           HE3      LYS  99  -4.017   3.721  -5.869
  801    HE3  LYS  99           HE2      LYS  99  -5.454   3.869  -4.858
  802    HZ1  LYS  99           HZ1      LYS  99  -4.098   1.630  -5.555
  803    HZ2  LYS  99           HZ2      LYS  99  -5.612   1.585  -6.305
  804    HZ3  LYS  99           HZ3      LYS  99  -5.506   1.769  -4.628
  805    H    LYS 100           H        LYS 100  -6.956   7.977  -4.039
  806    HA   LYS 100           HA       LYS 100  -6.115  10.491  -5.141
  807    HB2  LYS 100           HB3      LYS 100  -8.174  10.942  -4.367
  808    HB3  LYS 100           HB2      LYS 100  -8.161   9.536  -3.314
  809    HG2  LYS 100           HG3      LYS 100  -6.836  10.837  -1.673
  810    HG3  LYS 100           HG2      LYS 100  -7.016  12.252  -2.712
  811    HD2  LYS 100           HD3      LYS 100  -9.184  10.718  -1.289
  812    HD3  LYS 100           HD2      LYS 100  -8.693  12.392  -1.025
  813    HE2  LYS 100           HE3      LYS 100  -9.769  11.427  -3.660
  814    HE3  LYS 100           HE2      LYS 100 -10.821  12.005  -2.370
  815    HZ1  LYS 100           HZ1      LYS 100  -9.385  13.509  -4.249
  816    HZ2  LYS 100           HZ2      LYS 100  -8.780  13.876  -2.713
  817    HZ3  LYS 100           HZ3      LYS 100 -10.430  14.062  -3.039
  818    H    ALA 101           H        ALA 101  -5.464   8.612  -2.280
  819    HA   ALA 101           HA       ALA 101  -4.088  10.450  -0.712
  820    HB1  ALA 101           HB1      ALA 101  -3.314   7.561  -0.768
  821    HB2  ALA 101           HB2      ALA 101  -4.899   8.054  -0.172
  822    HB3  ALA 101           HB3      ALA 101  -3.435   8.659   0.607
  823    H    THR 102           H        THR 102  -3.096   8.687  -3.520
  824    HA   THR 102           HA       THR 102  -0.320   9.572  -3.132
  825    HB   THR 102           HB       THR 102  -0.252   7.305  -3.742
  826    HG1  THR 102           HG1      THR 102   0.882   7.460  -5.507
  827   HG21  THR 102          HG21      THR 102  -2.746   7.872  -5.129
  828   HG22  THR 102          HG22      THR 102  -2.160   6.376  -4.403
  829   HG23  THR 102          HG23      THR 102  -1.657   6.822  -6.035
  830    H    ASN 103           H        ASN 103  -3.251  10.062  -4.780
  831    HA   ASN 103           HA       ASN 103  -2.249  12.479  -5.946
  832    HB2  ASN 103           HB3      ASN 103  -3.634  10.784  -7.958
  833    HB3  ASN 103           HB2      ASN 103  -2.394  12.014  -8.186
  834   HD21  ASN 103          HD21      ASN 103  -2.984   8.700  -7.213
  835   HD22  ASN 103          HD22      ASN 103  -1.386   8.123  -7.523
  836    H    GLU 104           H        GLU 104  -3.793  13.917  -5.222
  837    HA   GLU 104           HA       GLU 104  -6.219  14.458  -6.108
  838    HB2  GLU 104           HB3      GLU 104  -6.385  12.078  -4.332
  839    HB3  GLU 104           HB2      GLU 104  -7.671  13.269  -4.232
  840    HG2  GLU 104           HG3      GLU 104  -7.009  12.529  -6.967
  841    HG3  GLU 104           HG2      GLU 104  -7.558  11.170  -5.988
  842    HHA  HEC 201           HHA      HEC 201   5.114  -4.977   0.439
  843    HHB  HEC 201           HHB      HEC 201  -0.263  -2.295   0.303
  844    HHC  HEC 201           HHC      HEC 201  -1.884  -5.950   5.188
  845    HHD  HEC 201           HHD      HEC 201   4.055  -5.679   6.756
  846   HMA1  HEC 201          HMA1      HEC 201   0.860  -1.047  -1.093
  847   HMA2  HEC 201          HMA2      HEC 201   2.437  -0.394  -0.670
  848   HMA3  HEC 201          HMA3      HEC 201   2.270  -1.483  -1.406
  849   HAA1  HEC 201          HAA1      HEC 201   4.932  -3.058  -1.483
  850   HAA2  HEC 201          HAA2      HEC 201   5.528  -2.426   0.059
  851   HBA1  HEC 201          HBA1      HEC 201   4.032  -0.429  -0.228
  852   HBA2  HEC 201          HBA2      HEC 201   3.774  -0.966  -1.823
  853   HMB1  HEC 201          HMB1      HEC 201  -3.431  -1.776   2.014
  854   HMB2  HEC 201          HMB2      HEC 201  -3.524  -3.058   0.789
  855   HMB3  HEC 201          HMB3      HEC 201  -2.255  -1.809   0.676
  856    HAB  HEC 201           HAB      HEC 201  -3.731  -3.108   4.519
  857   HBB1  HEC 201          HBB1      HEC 201  -5.187  -5.071   2.733
  858   HBB2  HEC 201          HBB2      HEC 201  -4.539  -3.577   2.022
  859   HBB3  HEC 201          HBB3      HEC 201  -5.652  -3.491   3.417
  860   HMC1  HEC 201          HMC1      HEC 201  -0.935  -7.381   8.516
  861   HMC2  HEC 201          HMC2      HEC 201  -1.735  -7.553   6.930
  862   HMC3  HEC 201          HMC3      HEC 201  -0.584  -8.141   7.260
  863    HAC  HEC 201           HAC      HEC 201   2.990  -6.683   8.250
  864   HBC1  HEC 201          HBC1      HEC 201   3.263  -9.071   7.693
  865   HBC2  HEC 201          HBC2      HEC 201   1.611  -9.380   8.265
  866   HBC3  HEC 201          HBC3      HEC 201   2.864  -8.830   9.412
  867   HMD1  HEC 201          HMD1      HEC 201   5.975  -6.884   6.344
  868   HMD2  HEC 201          HMD2      HEC 201   7.122  -5.591   5.939
  869   HMD3  HEC 201          HMD3      HEC 201   7.210  -7.160   5.088
  870   HAD1  HEC 201          HAD1      HEC 201   7.908  -6.172   3.109
  871   HAD2  HEC 201          HAD2      HEC 201   7.503  -4.745   2.139
  872   HBD1  HEC 201          HBD1      HEC 201   7.802  -7.410   1.251
  873   HBD2  HEC 201          HBD2      HEC 201   7.262  -6.005   0.311
  Start of MODEL   13
    1    H1   GLY   1          1H        GLY   1 -19.408   4.018  -0.412
    2    H2   GLY   1          2H        GLY   1 -18.801   3.491  -1.900
    3    H3   GLY   1          3H        GLY   1 -18.971   5.145  -1.596
    4    HA2  GLY   1           HA2      GLY   1 -17.336   3.776   0.340
    5    HA3  GLY   1           HA3      GLY   1 -16.686   3.736  -1.292
    6    H    ASP   2           H        ASP   2 -16.599   5.364   1.534
    7    HA   ASP   2           HA       ASP   2 -16.019   7.918   0.184
    8    HB2  ASP   2           HB3      ASP   2 -16.629   7.598   3.176
    9    HB3  ASP   2           HB2      ASP   2 -16.667   9.085   2.138
   10    H    VAL   3           H        VAL   3 -14.249   9.185   1.053
   11    HA   VAL   3           HA       VAL   3 -11.891   7.686   1.371
   12    HB   VAL   3           HB       VAL   3 -12.582  10.571   1.504
   13   HG11  VAL   3          HG11      VAL   3 -11.251  10.643   3.403
   14   HG12  VAL   3          HG12      VAL   3 -10.098  10.961   2.108
   15   HG13  VAL   3          HG13      VAL   3 -10.192   9.355   2.831
   16   HG21  VAL   3          HG21      VAL   3 -11.831  10.292  -0.579
   17   HG22  VAL   3          HG22      VAL   3 -11.107   8.729  -0.196
   18   HG23  VAL   3          HG23      VAL   3 -10.218  10.218   0.130
   19    H    GLU   4           H        GLU   4 -13.924   9.401   3.707
   20    HA   GLU   4           HA       GLU   4 -12.288   9.107   6.007
   21    HB2  GLU   4           HB3      GLU   4 -14.208  10.575   6.039
   22    HB3  GLU   4           HB2      GLU   4 -15.301   9.220   5.792
   23    HG2  GLU   4           HG3      GLU   4 -14.407   8.316   8.000
   24    HG3  GLU   4           HG2      GLU   4 -13.716   9.920   8.238
   25    H    LYS   5           H        LYS   5 -14.830   6.965   4.760
   26    HA   LYS   5           HA       LYS   5 -14.652   5.046   6.820
   27    HB2  LYS   5           HB3      LYS   5 -15.524   4.611   3.957
   28    HB3  LYS   5           HB2      LYS   5 -15.911   3.589   5.333
   29    HG2  LYS   5           HG3      LYS   5 -16.819   6.045   6.142
   30    HG3  LYS   5           HG2      LYS   5 -17.170   6.045   4.412
   31    HD2  LYS   5           HD3      LYS   5 -17.839   3.545   5.796
   32    HD3  LYS   5           HD2      LYS   5 -18.770   4.949   6.324
   33    HE2  LYS   5           HE3      LYS   5 -20.042   4.785   4.515
   34    HE3  LYS   5           HE2      LYS   5 -18.624   5.025   3.496
   35    HZ1  LYS   5           HZ1      LYS   5 -20.149   2.690   3.855
   36    HZ2  LYS   5           HZ2      LYS   5 -18.571   2.390   4.385
   37    HZ3  LYS   5           HZ3      LYS   5 -18.841   2.948   2.811
   38    H    GLY   6           H        GLY   6 -12.985   5.403   3.756
   39    HA2  GLY   6           HA3      GLY   6 -11.715   2.896   3.677
   40    HA3  GLY   6           HA2      GLY   6 -11.151   4.345   2.860
   41    H    LYS   7           H        LYS   7 -10.698   5.988   5.051
   42    HA   LYS   7           HA       LYS   7  -8.105   5.269   5.704
   43    HB2  LYS   7           HB3      LYS   7  -8.514   7.538   5.922
   44    HB3  LYS   7           HB2      LYS   7 -10.029   7.287   6.779
   45    HG2  LYS   7           HG3      LYS   7  -7.871   6.236   8.334
   46    HG3  LYS   7           HG2      LYS   7  -7.510   7.897   7.857
   47    HD2  LYS   7           HD3      LYS   7 -10.185   7.958   8.599
   48    HD3  LYS   7           HD2      LYS   7  -9.428   6.897   9.787
   49    HE2  LYS   7           HE3      LYS   7  -8.919   8.816  10.839
   50    HE3  LYS   7           HE2      LYS   7  -7.613   8.905   9.657
   51    HZ1  LYS   7           HZ1      LYS   7  -8.538  10.926   9.321
   52    HZ2  LYS   7           HZ2      LYS   7 -10.083  10.447   9.817
   53    HZ3  LYS   7           HZ3      LYS   7  -9.532  10.050   8.268
   54    H    LYS   8           H        LYS   8 -10.865   4.984   7.570
   55    HA   LYS   8           HA       LYS   8  -9.910   3.868   9.982
   56    HB2  LYS   8           HB3      LYS   8 -12.047   4.612  10.276
   57    HB3  LYS   8           HB2      LYS   8 -12.544   4.156   8.653
   58    HG2  LYS   8           HG3      LYS   8 -11.938   1.952  10.524
   59    HG3  LYS   8           HG2      LYS   8 -13.393   2.897  10.842
   60    HD2  LYS   8           HD3      LYS   8 -14.305   2.377   8.719
   61    HD3  LYS   8           HD2      LYS   8 -12.768   1.729   8.141
   62    HE2  LYS   8           HE3      LYS   8 -14.013   0.481  10.535
   63    HE3  LYS   8           HE2      LYS   8 -14.729   0.151   8.957
   64    HZ1  LYS   8           HZ1      LYS   8 -11.847  -0.222   9.544
   65    HZ2  LYS   8           HZ2      LYS   8 -12.700  -0.758   8.185
   66    HZ3  LYS   8           HZ3      LYS   8 -12.992  -1.459   9.695
   67    H    ILE   9           H        ILE   9 -11.016   2.430   6.953
   68    HA   ILE   9           HA       ILE   9 -11.047  -0.251   7.784
   69    HB   ILE   9           HB       ILE   9 -10.843   1.107   5.137
   70   HG12  ILE   9          HG13      ILE   9 -12.688  -1.032   6.228
   71   HG13  ILE   9          HG12      ILE   9 -13.024   0.698   6.247
   72   HG21  ILE   9          HG21      ILE   9 -10.595  -1.931   5.366
   73   HG22  ILE   9          HG22      ILE   9  -9.203  -0.808   5.156
   74   HG23  ILE   9          HG23      ILE   9 -10.470  -0.896   3.932
   75   HD11  ILE   9          HD11      ILE   9 -13.202  -1.296   4.025
   76   HD12  ILE   9          HD12      ILE   9 -12.530   0.336   3.627
   77   HD13  ILE   9          HD13      ILE   9 -14.131   0.218   4.358
   78    H    PHE  10           H        PHE  10  -8.489   1.707   6.309
   79    HA   PHE  10           HA       PHE  10  -6.547  -0.341   6.161
   80    HB2  PHE  10           HB3      PHE  10  -5.956   1.432   4.826
   81    HB3  PHE  10           HB2      PHE  10  -6.540   2.630   5.974
   82    HD1  PHE  10           HD1      PHE  10  -3.697   1.370   4.481
   83    HD2  PHE  10           HD2      PHE  10  -5.159   2.575   8.293
   84    HE1  PHE  10           HE1      PHE  10  -1.389   1.759   5.240
   85    HE2  PHE  10           HE2      PHE  10  -2.853   2.967   9.059
   86    HZ   PHE  10           HZ       PHE  10  -0.964   2.559   7.531
   87    H    VAL  11           H        VAL  11  -7.386   1.986   8.651
   88    HA   VAL  11           HA       VAL  11  -5.216   1.812  10.331
   89    HB   VAL  11           HB       VAL  11  -8.132   2.072  11.040
   90   HG11  VAL  11          HG11      VAL  11  -5.681   2.255  12.768
   91   HG12  VAL  11          HG12      VAL  11  -7.141   1.299  13.027
   92   HG13  VAL  11          HG13      VAL  11  -7.195   3.054  13.194
   93   HG21  VAL  11          HG21      VAL  11  -6.248   3.842   9.882
   94   HG22  VAL  11          HG22      VAL  11  -6.580   4.409  11.520
   95   HG23  VAL  11          HG23      VAL  11  -7.906   4.178  10.378
   96    H    GLN  12           H        GLN  12  -8.039  -0.408  10.288
   97    HA   GLN  12           HA       GLN  12  -6.729  -2.110  12.320
   98    HB2  GLN  12           HB3      GLN  12  -9.074  -3.309  11.025
   99    HB3  GLN  12           HB2      GLN  12  -8.809  -2.853  12.724
  100    HG2  GLN  12           HG3      GLN  12  -9.202  -0.449  11.602
  101    HG3  GLN  12           HG2      GLN  12 -10.230  -1.477  10.629
  102   HE21  GLN  12          HE21      GLN  12 -12.014  -0.280  11.545
  103   HE22  GLN  12          HE22      GLN  12 -12.571  -0.661  13.129
  104    H    LYS  13           H        LYS  13  -7.810  -2.154   9.116
  105    HA   LYS  13           HA       LYS  13  -7.301  -4.122   7.561
  106    HB2  LYS  13           HB3      LYS  13  -6.889  -1.388   7.340
  107    HB3  LYS  13           HB2      LYS  13  -5.397  -2.124   6.800
  108    HG2  LYS  13           HG3      LYS  13  -8.033  -2.104   5.631
  109    HG3  LYS  13           HG2      LYS  13  -6.472  -2.215   4.838
  110    HD2  LYS  13           HD3      LYS  13  -6.306  -4.522   5.768
  111    HD3  LYS  13           HD2      LYS  13  -8.053  -4.371   6.137
  112    HE2  LYS  13           HE3      LYS  13  -6.792  -4.920   3.615
  113    HE3  LYS  13           HE2      LYS  13  -8.525  -4.934   4.055
  114    HZ1  LYS  13           HZ1      LYS  13  -8.676  -2.618   3.565
  115    HZ2  LYS  13           HZ2      LYS  13  -7.989  -3.361   2.258
  116    HZ3  LYS  13           HZ3      LYS  13  -7.047  -2.496   3.303
  117    H    CYS  14           H        CYS  14  -4.588  -2.474   9.111
  118    HA   CYS  14           HA       CYS  14  -2.864  -4.455   9.510
  119    HB2  CYS  14           HB3      CYS  14  -1.474  -4.868   7.595
  120    HB3  CYS  14           HB2      CYS  14  -3.141  -5.506   7.454
  121    H    ALA  15           H        ALA  15  -3.402  -1.465   9.696
  122    HA   ALA  15           HA       ALA  15  -1.316  -0.131   8.512
  123    HB1  ALA  15           HB1      ALA  15  -2.546   0.714  11.121
  124    HB2  ALA  15           HB2      ALA  15  -3.376   0.879   9.548
  125    HB3  ALA  15           HB3      ALA  15  -1.870   1.736   9.853
  126    H    GLN  16           H        GLN  16  -1.405  -1.927  11.502
  127    HA   GLN  16           HA       GLN  16   0.764  -0.951  12.797
  128    HB2  GLN  16           HB3      GLN  16   0.470  -3.889  12.846
  129    HB3  GLN  16           HB2      GLN  16   0.545  -2.740  14.176
  130    HG2  GLN  16           HG3      GLN  16  -1.756  -2.056  13.531
  131    HG3  GLN  16           HG2      GLN  16  -1.758  -3.488  12.483
  132   HE21  GLN  16          HE21      GLN  16  -0.640  -2.709  15.789
  133   HE22  GLN  16          HE22      GLN  16  -1.340  -4.015  16.563
  134    H    CYS  17           H        CYS  17   0.546  -3.157  10.109
  135    HA   CYS  17           HA       CYS  17   3.342  -3.813  10.110
  136    HB2  CYS  17           HB3      CYS  17   1.463  -4.153   7.762
  137    HB3  CYS  17           HB2      CYS  17   2.853  -5.154   8.201
  138    H    HIS  18           H        HIS  18   1.407  -1.285   8.871
  139    HA   HIS  18           HA       HIS  18   3.612  -0.392   7.139
  140    HB2  HIS  18           HB3      HIS  18   0.715   0.477   7.069
  141    HB3  HIS  18           HB2      HIS  18   1.943   0.970   5.905
  142    HD1  HIS  18           HD1      HIS  18   1.691  -0.171   3.745
  143    HD2  HIS  18           HD2      HIS  18   0.717  -2.634   7.024
  144    HE1  HIS  18           HE1      HIS  18   1.046  -2.416   2.800
  145    H    THR  19           H        THR  19   3.129  -0.035  10.134
  146    HA   THR  19           HA       THR  19   3.309   1.576  11.716
  147    HB   THR  19           HB       THR  19   4.724   3.038   9.540
  148    HG1  THR  19           HG1      THR  19   6.584   1.986  10.294
  149   HG21  THR  19          HG21      THR  19   5.197   3.173  12.491
  150   HG22  THR  19          HG22      THR  19   4.279   4.384  11.554
  151   HG23  THR  19          HG23      THR  19   5.962   4.142  11.220
  152    H    VAL  20           H        VAL  20   2.659   3.675  12.411
  153    HA   VAL  20           HA       VAL  20   0.349   4.554  11.091
  154    HB   VAL  20           HB       VAL  20   1.375   5.915  13.502
  155   HG11  VAL  20          HG11      VAL  20  -0.675   6.544  12.209
  156   HG12  VAL  20          HG12      VAL  20  -0.717   6.479  13.931
  157   HG13  VAL  20          HG13      VAL  20  -1.386   5.153  12.999
  158   HG21  VAL  20          HG21      VAL  20   0.463   4.193  14.945
  159   HG22  VAL  20          HG22      VAL  20   1.569   3.482  13.858
  160   HG23  VAL  20          HG23      VAL  20  -0.055   3.281  13.528
  161    H    GLU  21           H        GLU  21   1.342   7.180  12.416
  162    HA   GLU  21           HA       GLU  21   1.641   8.650  10.017
  163    HB2  GLU  21           HB3      GLU  21   1.933  10.226  12.418
  164    HB3  GLU  21           HB2      GLU  21   0.845  10.410  11.095
  165    HG2  GLU  21           HG3      GLU  21  -0.634   8.745  12.189
  166    HG3  GLU  21           HG2      GLU  21   0.543   8.599  13.508
  167    H    LYS  22           H        LYS  22   3.324   9.792   9.468
  168    HA   LYS  22           HA       LYS  22   5.808   8.640   9.988
  169    HB2  LYS  22           HB3      LYS  22   5.113  10.289   8.143
  170    HB3  LYS  22           HB2      LYS  22   5.536  11.526   9.271
  171    HG2  LYS  22           HG3      LYS  22   7.310   9.417   8.061
  172    HG3  LYS  22           HG2      LYS  22   7.409  11.196   7.858
  173    HD2  LYS  22           HD3      LYS  22   7.929   9.720  10.438
  174    HD3  LYS  22           HD2      LYS  22   9.115  10.531   9.388
  175    HE2  LYS  22           HE3      LYS  22   8.210  12.684   9.841
  176    HE3  LYS  22           HE2      LYS  22   6.822  11.985  10.714
  177    HZ1  LYS  22           HZ1      LYS  22   9.317  12.738  11.680
  178    HZ2  LYS  22           HZ2      LYS  22   9.194  11.058  11.857
  179    HZ3  LYS  22           HZ3      LYS  22   8.034  12.056  12.549
  180    H    GLY  23           H        GLY  23   7.049   8.612  11.688
  181    HA2  GLY  23           HA3      GLY  23   8.175  10.463  13.184
  182    HA3  GLY  23           HA2      GLY  23   6.584  10.516  13.832
  183    H    GLY  24           H        GLY  24   6.091   7.664  13.508
  184    HA2  GLY  24           HA3      GLY  24   7.304   6.754  15.969
  185    HA3  GLY  24           HA2      GLY  24   6.193   5.838  14.961
  186    H    LYS  25           H        LYS  25   7.122   3.953  14.496
  187    HA   LYS  25           HA       LYS  25   9.944   3.951  13.758
  188    HB2  LYS  25           HB3      LYS  25   8.750   1.335  14.235
  189    HB3  LYS  25           HB2      LYS  25  10.250   2.128  14.945
  190    HG2  LYS  25           HG3      LYS  25   9.119   2.829  16.743
  191    HG3  LYS  25           HG2      LYS  25   7.610   3.018  15.893
  192    HD2  LYS  25           HD3      LYS  25   8.839   0.431  16.802
  193    HD3  LYS  25           HD2      LYS  25   7.378   1.212  17.495
  194    HE2  LYS  25           HE3      LYS  25   6.080   0.237  15.987
  195    HE3  LYS  25           HE2      LYS  25   6.973   0.964  14.699
  196    HZ1  LYS  25           HZ1      LYS  25   7.013  -1.710  15.701
  197    HZ2  LYS  25           HZ2      LYS  25   8.550  -1.097  15.497
  198    HZ3  LYS  25           HZ3      LYS  25   7.507  -1.145  14.211
  199    H    HIS  26           H        HIS  26  10.697   2.572  12.101
  200    HA   HIS  26           HA       HIS  26   9.090   2.804   9.789
  201    HB2  HIS  26           HB3      HIS  26  10.998   0.745   9.387
  202    HB3  HIS  26           HB2      HIS  26  11.015   2.391   8.807
  203    HD1  HIS  26           HD1      HIS  26  11.751   0.725  12.161
  204    HD2  HIS  26           HD2      HIS  26  13.279   3.611   9.591
  205    HE1  HIS  26           HE1      HIS  26  13.883   1.536  13.220
  206    HE2  HIS  26           HE2      HIS  26  14.736   3.335  11.720
  207    H    LYS  27           H        LYS  27   7.765   1.402   8.627
  208    HA   LYS  27           HA       LYS  27   6.700  -0.822  10.171
  209    HB2  LYS  27           HB3      LYS  27   4.840  -0.709   8.774
  210    HB3  LYS  27           HB2      LYS  27   5.380   0.976   8.694
  211    HG2  LYS  27           HG3      LYS  27   6.718  -0.301   6.632
  212    HG3  LYS  27           HG2      LYS  27   5.121  -1.014   6.629
  213    HD2  LYS  27           HD3      LYS  27   5.562   1.098   5.252
  214    HD3  LYS  27           HD2      LYS  27   4.115   1.064   6.234
  215    HE2  LYS  27           HE3      LYS  27   4.711   2.732   7.482
  216    HE3  LYS  27           HE2      LYS  27   6.347   2.071   7.749
  217    HZ1  LYS  27           HZ1      LYS  27   7.125   3.027   5.720
  218    HZ2  LYS  27           HZ2      LYS  27   6.324   4.248   6.538
  219    HZ3  LYS  27           HZ3      LYS  27   5.600   3.482   5.264
  220    H    THR  28           H        THR  28   6.026  -2.812   8.786
  221    HA   THR  28           HA       THR  28   8.500  -4.081   7.952
  222    HB   THR  28           HB       THR  28   5.881  -5.250   7.215
  223    HG1  THR  28           HG1      THR  28   6.709  -5.289   9.864
  224   HG21  THR  28          HG21      THR  28   6.840  -7.183   7.842
  225   HG22  THR  28          HG22      THR  28   7.981  -6.548   8.852
  226   HG23  THR  28          HG23      THR  28   8.215  -6.261   7.144
  227    H    GLY  29           H        GLY  29   5.702  -2.740   6.218
  228    HA2  GLY  29           HA3      GLY  29   7.306  -2.853   3.760
  229    HA3  GLY  29           HA2      GLY  29   5.667  -3.411   3.755
  230    HA   PRO  30           HA       PRO  30   6.529   1.366   2.974
  231    HB2  PRO  30           HB3      PRO  30   5.414   0.361   0.467
  232    HB3  PRO  30           HB2      PRO  30   6.566   1.685   0.783
  233    HG2  PRO  30           HG3      PRO  30   7.422  -0.692  -0.106
  234    HG3  PRO  30           HG2      PRO  30   8.355   0.198   1.107
  235    HD2  PRO  30           HD3      PRO  30   6.780  -2.200   1.350
  236    HD3  PRO  30           HD2      PRO  30   8.155  -1.582   2.284
  237    H    ASN  31           H        ASN  31   4.886   2.408   3.890
  238    HA   ASN  31           HA       ASN  31   2.338   1.464   4.280
  239    HB2  ASN  31           HB3      ASN  31   3.607   3.569   5.270
  240    HB3  ASN  31           HB2      ASN  31   2.651   4.380   4.043
  241   HD21  ASN  31          HD21      ASN  31   2.007   5.305   6.254
  242   HD22  ASN  31          HD22      ASN  31   0.705   4.585   6.938
  243    H    LEU  32           H        LEU  32   3.207   3.988   2.095
  244    HA   LEU  32           HA       LEU  32   1.729   2.940   0.053
  245    HB2  LEU  32           HB3      LEU  32  -0.168   4.449  -0.210
  246    HB3  LEU  32           HB2      LEU  32  -0.204   3.489   1.259
  247    HG   LEU  32           HG       LEU  32  -1.254   5.618   1.822
  248   HD11  LEU  32          HD11      LEU  32   1.410   5.246   2.763
  249   HD12  LEU  32          HD12      LEU  32  -0.017   4.565   3.542
  250   HD13  LEU  32          HD13      LEU  32   0.250   6.307   3.563
  251   HD21  LEU  32          HD21      LEU  32  -0.481   7.580   1.060
  252   HD22  LEU  32          HD22      LEU  32   0.189   6.504  -0.166
  253   HD23  LEU  32          HD23      LEU  32   1.180   7.022   1.204
  254    H    HIS  33           H        HIS  33   3.185   5.626   1.540
  255    HA   HIS  33           HA       HIS  33   3.288   7.550  -0.408
  256    HB2  HIS  33           HB3      HIS  33   4.606   7.070   2.067
  257    HB3  HIS  33           HB2      HIS  33   5.905   7.291   0.837
  258    HD1  HIS  33           HD1      HIS  33   6.555   9.555   1.979
  259    HD2  HIS  33           HD2      HIS  33   2.764   9.483   0.278
  260    HE1  HIS  33           HE1      HIS  33   5.818  11.920   1.875
  261    HE2  HIS  33           HE2      HIS  33   3.473  11.874   0.934
  262    H    GLY  34           H        GLY  34   4.020   7.627  -2.406
  263    HA2  GLY  34           HA3      GLY  34   5.325   7.267  -4.272
  264    HA3  GLY  34           HA2      GLY  34   6.491   6.454  -3.233
  265    H    LEU  35           H        LEU  35   3.282   5.252  -2.982
  266    HA   LEU  35           HA       LEU  35   4.017   2.654  -3.781
  267    HB2  LEU  35           HB3      LEU  35   2.071   3.287  -2.308
  268    HB3  LEU  35           HB2      LEU  35   1.226   3.894  -3.728
  269    HG   LEU  35           HG       LEU  35   1.174   1.632  -4.695
  270   HD11  LEU  35          HD11      LEU  35   2.358  -0.045  -3.906
  271   HD12  LEU  35          HD12      LEU  35   2.220   0.342  -2.255
  272   HD13  LEU  35          HD13      LEU  35   3.409   1.098  -3.276
  273   HD21  LEU  35          HD21      LEU  35   0.331   1.991  -1.873
  274   HD22  LEU  35          HD22      LEU  35   0.009   0.490  -2.740
  275   HD23  LEU  35          HD23      LEU  35  -0.608   2.010  -3.384
  276    H    PHE  36           H        PHE  36   2.213   5.185  -5.524
  277    HA   PHE  36           HA       PHE  36   2.533   3.618  -7.987
  278    HB2  PHE  36           HB3      PHE  36   0.789   5.912  -7.905
  279    HB3  PHE  36           HB2      PHE  36   0.677   4.355  -8.741
  280    HD1  PHE  36           HD1      PHE  36  -0.372   2.570  -7.714
  281    HD2  PHE  36           HD2      PHE  36   0.193   6.059  -5.548
  282    HE1  PHE  36           HE1      PHE  36  -1.904   1.740  -5.946
  283    HE2  PHE  36           HE2      PHE  36  -1.358   5.192  -3.797
  284    HZ   PHE  36           HZ       PHE  36  -2.413   3.018  -4.050
  285    H    GLY  37           H        GLY  37   4.277   5.714  -6.505
  286    HA2  GLY  37           HA3      GLY  37   4.823   7.355  -8.904
  287    HA3  GLY  37           HA2      GLY  37   4.933   8.003  -7.266
  288    H    ARG  38           H        ARG  38   6.196   5.756  -6.056
  289    HA   ARG  38           HA       ARG  38   8.917   6.173  -7.062
  290    HB2  ARG  38           HB3      ARG  38   7.808   4.848  -4.605
  291    HB3  ARG  38           HB2      ARG  38   9.568   4.895  -4.995
  292    HG2  ARG  38           HG3      ARG  38   9.250   7.458  -5.076
  293    HG3  ARG  38           HG2      ARG  38   7.697   7.131  -4.296
  294    HD2  ARG  38           HD3      ARG  38   8.697   6.914  -2.312
  295    HD3  ARG  38           HD2      ARG  38   9.752   5.693  -2.964
  296    HE   ARG  38           HE       ARG  38  11.387   7.248  -2.729
  297   HH11  ARG  38          HH11      ARG  38   8.454   8.816  -3.762
  298   HH12  ARG  38          HH12      ARG  38   9.182  10.382  -3.888
  299   HH21  ARG  38          HH21      ARG  38  12.324   9.300  -2.862
  300   HH22  ARG  38          HH22      ARG  38  11.401  10.661  -3.391
  301    H    LYS  39           H        LYS  39  10.423   4.200  -7.088
  302    HA   LYS  39           HA       LYS  39   9.636   2.472  -9.030
  303    HB2  LYS  39           HB3      LYS  39  11.984   2.934  -8.444
  304    HB3  LYS  39           HB2      LYS  39  11.774   2.036  -6.913
  305    HG2  LYS  39           HG3      LYS  39  12.763   0.979  -9.233
  306    HG3  LYS  39           HG2      LYS  39  12.058   0.150  -7.894
  307    HD2  LYS  39           HD3      LYS  39  11.105  -0.497 -10.033
  308    HD3  LYS  39           HD2      LYS  39   9.891   0.220  -8.958
  309    HE2  LYS  39           HE3      LYS  39  10.451   2.307 -10.250
  310    HE3  LYS  39           HE2      LYS  39  11.248   1.419 -11.385
  311    HZ1  LYS  39           HZ1      LYS  39   9.265   0.600 -12.121
  312    HZ2  LYS  39           HZ2      LYS  39   8.717   2.114 -11.545
  313    HZ3  LYS  39           HZ3      LYS  39   8.487   0.703 -10.578
  314    H    THR  40           H        THR  40  10.788   0.856  -6.164
  315    HA   THR  40           HA       THR  40   8.183  -0.073  -5.314
  316    HB   THR  40           HB       THR  40   8.682  -2.341  -5.067
  317    HG1  THR  40           HG1      THR  40  10.162  -3.536  -5.971
  318   HG21  THR  40          HG21      THR  40   8.360  -2.099  -7.818
  319   HG22  THR  40          HG22      THR  40   8.646  -2.936  -6.607
  320   HG23  THR  40          HG23      THR  40   7.255  -2.954  -6.304
  321    H    GLY  41           H        GLY  41   8.150   0.335  -3.544
  322    HA2  GLY  41           HA3      GLY  41   8.664   0.408  -1.293
  323    HA3  GLY  41           HA2      GLY  41   9.324  -1.186  -1.586
  324    H    GLN  42           H        GLN  42  10.525   1.784  -2.974
  325    HA   GLN  42           HA       GLN  42  13.071   1.316  -1.664
  326    HB2  GLN  42           HB3      GLN  42  13.552   3.336  -3.448
  327    HB3  GLN  42           HB2      GLN  42  13.800   1.583  -3.753
  328    HG2  GLN  42           HG3      GLN  42  12.521   2.793  -5.546
  329    HG3  GLN  42           HG2      GLN  42  11.685   1.446  -4.823
  330   HE21  GLN  42          HE21      GLN  42   9.620   1.955  -4.823
  331   HE22  GLN  42          HE22      GLN  42   8.913   3.469  -4.326
  332    H    ALA  43           H        ALA  43  11.181   2.361  -0.008
  333    HA   ALA  43           HA       ALA  43  10.976   5.091   0.168
  334    HB1  ALA  43           HB1      ALA  43  11.106   4.293   2.812
  335    HB2  ALA  43           HB2      ALA  43  10.545   2.829   1.935
  336    HB3  ALA  43           HB3      ALA  43   9.660   4.357   1.807
  337    HA   PRO  44           HA       PRO  44  14.803   6.592   1.701
  338    HB2  PRO  44           HB3      PRO  44  14.193   8.288   3.734
  339    HB3  PRO  44           HB2      PRO  44  13.707   8.585   2.025
  340    HG2  PRO  44           HG3      PRO  44  12.117   7.477   4.331
  341    HG3  PRO  44           HG2      PRO  44  11.651   8.671   3.125
  342    HD2  PRO  44           HD3      PRO  44  10.998   5.965   3.011
  343    HD3  PRO  44           HD2      PRO  44  11.111   7.070   1.581
  344    H    GLY  45           H        GLY  45  14.019   7.246   4.911
  345    HA2  GLY  45           HA3      GLY  45  16.042   5.472   5.897
  346    HA3  GLY  45           HA2      GLY  45  14.918   6.443   6.868
  347    H    PHE  46           H        PHE  46  13.163   4.606   4.644
  348    HA   PHE  46           HA       PHE  46  12.232   2.834   6.728
  349    HB2  PHE  46           HB3      PHE  46  10.640   3.832   5.191
  350    HB3  PHE  46           HB2      PHE  46  11.433   3.056   3.802
  351    HD1  PHE  46           HD1      PHE  46   9.647   2.355   7.009
  352    HD2  PHE  46           HD2      PHE  46  10.786   0.891   3.159
  353    HE1  PHE  46           HE1      PHE  46   8.202   0.392   7.288
  354    HE2  PHE  46           HE2      PHE  46   9.309  -1.095   3.417
  355    HZ   PHE  46           HZ       PHE  46   8.048  -1.327   5.544
  356    H    THR  47           H        THR  47  12.699   0.700   6.952
  357    HA   THR  47           HA       THR  47  14.852  -0.413   5.401
  358    HB   THR  47           HB       THR  47  13.920  -0.771   7.983
  359    HG1  THR  47           HG1      THR  47  15.655  -2.257   8.066
  360   HG21  THR  47          HG21      THR  47  13.598  -3.203   8.109
  361   HG22  THR  47          HG22      THR  47  13.333  -3.244   6.385
  362   HG23  THR  47          HG23      THR  47  12.227  -2.342   7.458
  363    H    TYR  48           H        TYR  48  14.333  -0.935   3.391
  364    HA   TYR  48           HA       TYR  48  11.822  -2.086   2.678
  365    HB2  TYR  48           HB3      TYR  48  13.732  -2.633   0.736
  366    HB3  TYR  48           HB2      TYR  48  12.462  -1.415   0.754
  367    HD1  TYR  48           HD1      TYR  48  15.917  -1.945   1.992
  368    HD2  TYR  48           HD2      TYR  48  13.073   0.817   0.583
  369    HE1  TYR  48           HE1      TYR  48  17.620  -0.225   2.155
  370    HE2  TYR  48           HE2      TYR  48  14.777   2.583   0.660
  371    HH   TYR  48           HH       TYR  48  17.892   2.080   2.146
  372    H    THR  49           H        THR  49  11.595  -4.132   1.693
  373    HA   THR  49           HA       THR  49  12.885  -6.214   3.175
  374    HB   THR  49           HB       THR  49  11.284  -7.637   2.059
  375    HG1  THR  49           HG1      THR  49   9.828  -6.617   0.519
  376   HG21  THR  49          HG21      THR  49   9.362  -5.554   2.237
  377   HG22  THR  49          HG22      THR  49  10.481  -5.513   3.601
  378   HG23  THR  49          HG23      THR  49   9.528  -6.991   3.245
  379    H    ASP  50           H        ASP  50  13.545  -8.233   1.763
  380    HA   ASP  50           HA       ASP  50  15.769  -7.617   0.312
  381    HB2  ASP  50           HB3      ASP  50  15.809  -9.817   1.004
  382    HB3  ASP  50           HB2      ASP  50  14.115 -10.084   0.606
  383    H    ALA  51           H        ALA  51  12.468  -8.045  -0.746
  384    HA   ALA  51           HA       ALA  51  13.013  -8.075  -3.498
  385    HB1  ALA  51           HB1      ALA  51  10.870  -8.652  -3.570
  386    HB2  ALA  51           HB2      ALA  51  10.366  -7.150  -2.966
  387    HB3  ALA  51           HB3      ALA  51  10.745  -8.489  -1.800
  388    H    ASN  52           H        ASN  52  11.921  -5.603  -1.171
  389    HA   ASN  52           HA       ASN  52  11.567  -3.515  -3.023
  390    HB2  ASN  52           HB3      ASN  52  12.334  -3.405  -0.091
  391    HB3  ASN  52           HB2      ASN  52  11.794  -2.088  -1.091
  392   HD21  ASN  52          HD21      ASN  52  10.044  -4.114  -2.479
  393   HD22  ASN  52          HD22      ASN  52   8.651  -4.135  -1.452
  394    H    LYS  53           H        LYS  53  14.383  -4.453  -1.110
  395    HA   LYS  53           HA       LYS  53  16.116  -2.510  -1.889
  396    HB2  LYS  53           HB3      LYS  53  17.954  -4.115  -1.319
  397    HB3  LYS  53           HB2      LYS  53  16.789  -3.839  -0.086
  398    HG2  LYS  53           HG3      LYS  53  15.669  -5.828  -0.429
  399    HG3  LYS  53           HG2      LYS  53  16.574  -6.120  -1.939
  400    HD2  LYS  53           HD3      LYS  53  17.766  -7.420  -0.484
  401    HD3  LYS  53           HD2      LYS  53  18.635  -5.940  -0.259
  402    HE2  LYS  53           HE3      LYS  53  18.116  -5.937   1.819
  403    HE3  LYS  53           HE2      LYS  53  16.432  -5.853   1.416
  404    HZ1  LYS  53           HZ1      LYS  53  17.952  -8.052   2.432
  405    HZ2  LYS  53           HZ2      LYS  53  17.091  -8.480   1.017
  406    HZ3  LYS  53           HZ3      LYS  53  16.270  -7.866   2.363
  407    H    ASN  54           H        ASN  54  15.124  -5.340  -3.490
  408    HA   ASN  54           HA       ASN  54  17.178  -5.258  -5.490
  409    HB2  ASN  54           HB3      ASN  54  14.553  -6.730  -5.422
  410    HB3  ASN  54           HB2      ASN  54  15.860  -6.982  -6.602
  411   HD21  ASN  54          HD21      ASN  54  17.227  -6.226  -3.732
  412   HD22  ASN  54          HD22      ASN  54  17.477  -7.819  -3.080
  413    H    LYS  55           H        LYS  55  14.225  -3.624  -4.933
  414    HA   LYS  55           HA       LYS  55  13.213  -1.951  -6.071
  415    HB2  LYS  55           HB3      LYS  55  15.497  -2.427  -7.973
  416    HB3  LYS  55           HB2      LYS  55  14.198  -1.237  -8.315
  417    HG2  LYS  55           HG3      LYS  55  15.001   0.188  -6.910
  418    HG3  LYS  55           HG2      LYS  55  15.374  -1.037  -5.707
  419    HD2  LYS  55           HD3      LYS  55  17.034  -0.223  -8.026
  420    HD3  LYS  55           HD2      LYS  55  17.447  -0.143  -6.338
  421    HE2  LYS  55           HE3      LYS  55  17.072  -2.674  -6.428
  422    HE3  LYS  55           HE2      LYS  55  17.386  -2.443  -8.152
  423    HZ1  LYS  55           HZ1      LYS  55  19.469  -2.922  -7.240
  424    HZ2  LYS  55           HZ2      LYS  55  19.238  -1.915  -5.888
  425    HZ3  LYS  55           HZ3      LYS  55  19.476  -1.224  -7.413
  426    H    GLY  56           H        GLY  56  11.786  -4.026  -6.128
  427    HA2  GLY  56           HA3      GLY  56  11.324  -5.516  -8.400
  428    HA3  GLY  56           HA2      GLY  56  10.105  -5.117  -7.244
  429    H    ILE  57           H        ILE  57   8.488  -3.746  -7.789
  430    HA   ILE  57           HA       ILE  57   8.929  -1.930 -10.037
  431    HB   ILE  57           HB       ILE  57   7.792  -4.321 -10.593
  432   HG12  ILE  57          HG13      ILE  57   8.645  -3.232 -12.383
  433   HG13  ILE  57          HG12      ILE  57   6.967  -2.910 -12.634
  434   HG21  ILE  57          HG21      ILE  57   5.736  -4.010  -9.557
  435   HG22  ILE  57          HG22      ILE  57   5.472  -3.640 -11.222
  436   HG23  ILE  57          HG23      ILE  57   5.666  -2.325 -10.135
  437   HD11  ILE  57          HD11      ILE  57   7.196  -0.696 -12.130
  438   HD12  ILE  57          HD12      ILE  57   8.818  -1.025 -12.635
  439   HD13  ILE  57          HD13      ILE  57   8.449  -1.029 -10.914
  440    H    THR  58           H        THR  58   6.955  -0.603 -10.465
  441    HA   THR  58           HA       THR  58   6.102   0.538  -7.925
  442    HB   THR  58           HB       THR  58   6.533   1.572 -10.529
  443    HG1  THR  58           HG1      THR  58   6.034   3.459  -9.531
  444   HG21  THR  58          HG21      THR  58   4.134   0.985 -11.070
  445   HG22  THR  58          HG22      THR  58   4.531   2.731 -11.109
  446   HG23  THR  58          HG23      THR  58   3.680   2.052  -9.722
  447    H    TRP  59           H        TRP  59   4.442  -0.240  -6.857
  448    HA   TRP  59           HA       TRP  59   2.465  -1.931  -8.012
  449    HB2  TRP  59           HB3      TRP  59   1.830  -0.538  -5.518
  450    HB3  TRP  59           HB2      TRP  59   1.818  -2.276  -5.844
  451    HD1  TRP  59           HD1      TRP  59   4.228   0.499  -4.910
  452    HE1  TRP  59           HE1      TRP  59   6.329  -0.514  -3.789
  453    HE3  TRP  59           HE3      TRP  59   3.115  -4.349  -5.593
  454    HZ2  TRP  59           HZ2      TRP  59   7.329  -3.101  -3.273
  455    HZ3  TRP  59           HZ3      TRP  59   4.646  -6.066  -4.732
  456    HH2  TRP  59           HH2      TRP  59   6.738  -5.459  -3.630
  457    H    LYS  60           H        LYS  60   1.096  -1.299  -9.504
  458    HA   LYS  60           HA       LYS  60  -0.108   1.308  -9.214
  459    HB2  LYS  60           HB3      LYS  60   0.179   1.445 -11.450
  460    HB3  LYS  60           HB2      LYS  60   0.755  -0.198 -11.481
  461    HG2  LYS  60           HG3      LYS  60  -0.956  -0.541 -12.851
  462    HG3  LYS  60           HG2      LYS  60  -1.838  -0.663 -11.307
  463    HD2  LYS  60           HD3      LYS  60  -2.981   1.261 -11.720
  464    HD3  LYS  60           HD2      LYS  60  -1.532   2.092 -12.240
  465    HE2  LYS  60           HE3      LYS  60  -2.196   0.160 -14.220
  466    HE3  LYS  60           HE2      LYS  60  -3.676   1.003 -13.801
  467    HZ1  LYS  60           HZ1      LYS  60  -1.760   1.845 -15.560
  468    HZ2  LYS  60           HZ2      LYS  60  -1.393   2.709 -14.136
  469    HZ3  LYS  60           HZ3      LYS  60  -2.914   2.819 -14.820
  470    H    GLU  61           H        GLU  61  -2.420   1.432 -10.031
  471    HA   GLU  61           HA       GLU  61  -4.037  -0.146  -8.261
  472    HB2  GLU  61           HB3      GLU  61  -4.461   2.043  -9.966
  473    HB3  GLU  61           HB2      GLU  61  -5.520   0.836 -10.618
  474    HG2  GLU  61           HG3      GLU  61  -5.800   0.817  -7.768
  475    HG3  GLU  61           HG2      GLU  61  -5.957   2.466  -8.374
  476    H    GLU  62           H        GLU  62  -3.870  -0.398 -11.845
  477    HA   GLU  62           HA       GLU  62  -5.454  -2.697 -11.997
  478    HB2  GLU  62           HB3      GLU  62  -4.953  -2.685 -14.286
  479    HB3  GLU  62           HB2      GLU  62  -4.617  -1.015 -13.856
  480    HG2  GLU  62           HG3      GLU  62  -2.231  -1.635 -13.660
  481    HG3  GLU  62           HG2      GLU  62  -2.648  -3.278 -14.170
  482    H    THR  63           H        THR  63  -1.904  -2.270 -11.780
  483    HA   THR  63           HA       THR  63  -1.209  -5.016 -12.137
  484    HB   THR  63           HB       THR  63   0.047  -2.587 -11.655
  485    HG1  THR  63           HG1      THR  63   1.393  -3.643 -12.903
  486   HG21  THR  63          HG21      THR  63   1.590  -2.895  -9.984
  487   HG22  THR  63          HG22      THR  63   1.266  -4.626  -9.899
  488   HG23  THR  63          HG23      THR  63   0.072  -3.510  -9.231
  489    H    LEU  64           H        LEU  64  -2.307  -3.190  -9.401
  490    HA   LEU  64           HA       LEU  64  -1.570  -5.057  -7.396
  491    HB2  LEU  64           HB3      LEU  64  -3.039  -2.542  -7.551
  492    HB3  LEU  64           HB2      LEU  64  -3.732  -3.665  -6.354
  493    HG   LEU  64           HG       LEU  64  -0.891  -2.668  -6.362
  494   HD11  LEU  64          HD11      LEU  64  -1.902  -0.867  -5.479
  495   HD12  LEU  64          HD12      LEU  64  -1.837  -1.899  -4.050
  496   HD13  LEU  64          HD13      LEU  64  -3.353  -1.851  -4.996
  497   HD21  LEU  64          HD21      LEU  64  -0.565  -3.843  -4.353
  498   HD22  LEU  64          HD22      LEU  64  -1.057  -5.002  -5.605
  499   HD23  LEU  64          HD23      LEU  64  -2.210  -4.465  -4.385
  500    H    MET  65           H        MET  65  -4.397  -4.544  -9.394
  501    HA   MET  65           HA       MET  65  -6.194  -6.256  -8.063
  502    HB2  MET  65           HB3      MET  65  -5.952  -5.479 -10.967
  503    HB3  MET  65           HB2      MET  65  -7.253  -6.467 -10.357
  504    HG2  MET  65           HG3      MET  65  -6.657  -3.623  -9.614
  505    HG3  MET  65           HG2      MET  65  -8.072  -4.249 -10.472
  506    HE1  MET  65           HE1      MET  65  -6.531  -3.150  -7.304
  507    HE2  MET  65           HE2      MET  65  -6.075  -4.828  -7.009
  508    HE3  MET  65           HE3      MET  65  -7.303  -4.056  -6.004
  509    H    GLU  66           H        GLU  66  -3.787  -6.931 -10.584
  510    HA   GLU  66           HA       GLU  66  -4.432  -9.714 -10.695
  511    HB2  GLU  66           HB3      GLU  66  -2.238  -9.787 -12.001
  512    HB3  GLU  66           HB2      GLU  66  -3.600  -8.897 -12.713
  513    HG2  GLU  66           HG3      GLU  66  -2.694  -6.813 -11.979
  514    HG3  GLU  66           HG2      GLU  66  -1.331  -7.613 -11.144
  515    H    TYR  67           H        TYR  67  -2.000  -7.664  -9.120
  516    HA   TYR  67           HA       TYR  67  -0.440  -9.712  -8.233
  517    HB2  TYR  67           HB3      TYR  67   0.613  -7.688  -7.947
  518    HB3  TYR  67           HB2      TYR  67  -0.906  -6.914  -7.560
  519    HD1  TYR  67           HD1      TYR  67   2.014  -8.622  -6.210
  520    HD2  TYR  67           HD2      TYR  67  -1.725  -6.989  -5.242
  521    HE1  TYR  67           HE1      TYR  67   2.603  -8.621  -3.843
  522    HE2  TYR  67           HE2      TYR  67  -1.122  -7.008  -2.849
  523    HH   TYR  67           HH       TYR  67   0.632  -7.108  -1.479
  524    H    LEU  68           H        LEU  68  -3.445  -8.723  -7.185
  525    HA   LEU  68           HA       LEU  68  -3.355  -9.566  -4.506
  526    HB2  LEU  68           HB3      LEU  68  -5.553  -9.252  -6.497
  527    HB3  LEU  68           HB2      LEU  68  -5.925  -9.901  -4.907
  528    HG   LEU  68           HG       LEU  68  -4.643  -7.196  -5.406
  529   HD11  LEU  68          HD11      LEU  68  -6.733  -6.191  -4.957
  530   HD12  LEU  68          HD12      LEU  68  -7.463  -7.742  -4.618
  531   HD13  LEU  68          HD13      LEU  68  -6.951  -7.385  -6.237
  532   HD21  LEU  68          HD21      LEU  68  -4.069  -8.142  -3.274
  533   HD22  LEU  68          HD22      LEU  68  -5.406  -7.202  -2.647
  534   HD23  LEU  68          HD23      LEU  68  -5.242  -6.798  -3.034
  535    H    GLU  69           H        GLU  69  -3.283 -11.349  -7.393
  536    HA   GLU  69           HA       GLU  69  -4.610 -13.708  -6.663
  537    HB2  GLU  69           HB3      GLU  69  -3.252 -12.823  -8.885
  538    HB3  GLU  69           HB2      GLU  69  -2.262 -14.092  -8.291
  539    HG2  GLU  69           HG3      GLU  69  -4.058 -15.673  -8.350
  540    HG3  GLU  69           HG2      GLU  69  -5.136 -14.392  -8.902
  541    H    ASN  70           H        ASN  70  -1.129 -13.615  -6.988
  542    HA   ASN  70           HA       ASN  70  -0.932 -15.096  -4.554
  543    HB2  ASN  70           HB3      ASN  70   0.444 -15.449  -7.136
  544    HB3  ASN  70           HB2      ASN  70   1.299 -15.847  -5.756
  545   HD21  ASN  70          HD21      ASN  70  -1.104 -16.715  -7.952
  546   HD22  ASN  70          HD22      ASN  70  -1.596 -18.204  -7.301
  547    HA   PRO  71           HA       PRO  71   1.120 -11.063  -3.597
  548    HB2  PRO  71           HB3      PRO  71   1.117 -12.555  -0.976
  549    HB3  PRO  71           HB2      PRO  71   0.697 -10.837  -1.343
  550    HG2  PRO  71           HG3      PRO  71  -1.196 -12.646  -0.868
  551    HG3  PRO  71           HG2      PRO  71  -1.427 -11.434  -2.092
  552    HD2  PRO  71           HD3      PRO  71  -0.803 -14.333  -2.414
  553    HD3  PRO  71           HD2      PRO  71  -1.790 -13.268  -3.437
  554    H    LYS  72           H        LYS  72   2.057 -14.372  -2.822
  555    HA   LYS  72           HA       LYS  72   4.773 -13.700  -2.190
  556    HB2  LYS  72           HB3      LYS  72   4.749 -15.680  -1.281
  557    HB3  LYS  72           HB2      LYS  72   3.122 -15.914  -1.761
  558    HG2  LYS  72           HG3      LYS  72   4.080 -17.773  -2.693
  559    HG3  LYS  72           HG2      LYS  72   4.272 -16.629  -3.994
  560    HD2  LYS  72           HD3      LYS  72   6.508 -16.342  -2.203
  561    HD3  LYS  72           HD2      LYS  72   6.311 -18.065  -2.644
  562    HE2  LYS  72           HE3      LYS  72   5.959 -16.646  -5.014
  563    HE3  LYS  72           HE2      LYS  72   7.371 -15.918  -4.203
  564    HZ1  LYS  72           HZ1      LYS  72   8.312 -18.132  -4.055
  565    HZ2  LYS  72           HZ2      LYS  72   7.964 -17.794  -5.667
  566    HZ3  LYS  72           HZ3      LYS  72   6.978 -18.836  -4.773
  567    H    LYS  73           H        LYS  73   2.960 -14.543  -4.997
  568    HA   LYS  73           HA       LYS  73   5.102 -15.524  -6.533
  569    HB2  LYS  73           HB3      LYS  73   3.547 -15.634  -8.250
  570    HB3  LYS  73           HB2      LYS  73   2.482 -15.725  -6.853
  571    HG2  LYS  73           HG3      LYS  73   1.358 -14.107  -7.957
  572    HG3  LYS  73           HG2      LYS  73   2.545 -13.055  -7.235
  573    HD2  LYS  73           HD3      LYS  73   2.150 -12.773  -9.744
  574    HD3  LYS  73           HD2      LYS  73   3.814 -12.884  -9.188
  575    HE2  LYS  73           HE3      LYS  73   3.301 -14.281 -11.221
  576    HE3  LYS  73           HE2      LYS  73   4.064 -15.151  -9.856
  577    HZ1  LYS  73           HZ1      LYS  73   1.736 -15.752  -9.158
  578    HZ2  LYS  73           HZ2      LYS  73   2.325 -16.506 -10.601
  579    HZ3  LYS  73           HZ3      LYS  73   1.199 -15.215 -10.719
  580    H    TYR  74           H        TYR  74   3.817 -12.349  -5.783
  581    HA   TYR  74           HA       TYR  74   5.334 -11.031  -7.871
  582    HB2  TYR  74           HB3      TYR  74   3.410 -10.233  -5.770
  583    HB3  TYR  74           HB2      TYR  74   4.598  -9.014  -6.222
  584    HD1  TYR  74           HD1      TYR  74   2.083 -11.330  -7.704
  585    HD2  TYR  74           HD2      TYR  74   4.232  -7.681  -8.095
  586    HE1  TYR  74           HE1      TYR  74   0.701 -10.746  -9.675
  587    HE2  TYR  74           HE2      TYR  74   2.855  -7.085 -10.066
  588    HH   TYR  74           HH       TYR  74   0.609  -9.369 -11.470
  589    H    ILE  75           H        ILE  75   5.550 -11.367  -4.347
  590    HA   ILE  75           HA       ILE  75   8.402 -10.613  -4.529
  591    HB   ILE  75           HB       ILE  75   6.411  -9.588  -2.588
  592   HG12  ILE  75          HG13      ILE  75   6.461  -8.103  -4.311
  593   HG13  ILE  75          HG12      ILE  75   7.643  -7.437  -3.171
  594   HG21  ILE  75          HG21      ILE  75   8.435  -8.523  -1.492
  595   HG22  ILE  75          HG22      ILE  75   9.415  -9.640  -2.402
  596   HG23  ILE  75          HG23      ILE  75   8.231 -10.243  -1.274
  597   HD11  ILE  75          HD11      ILE  75   8.949  -7.331  -5.007
  598   HD12  ILE  75          HD12      ILE  75   7.995  -8.516  -5.842
  599   HD13  ILE  75          HD13      ILE  75   9.175  -9.044  -4.709
  600    HA   PRO  76           HA       PRO  76   7.927 -14.743  -2.651
  601    HB2  PRO  76           HB3      PRO  76  10.617 -14.987  -3.814
  602    HB3  PRO  76           HB2      PRO  76   9.273 -16.084  -3.877
  603    HG2  PRO  76           HG3      PRO  76   9.914 -14.686  -5.979
  604    HG3  PRO  76           HG2      PRO  76   8.183 -15.041  -5.526
  605    HD2  PRO  76           HD3      PRO  76   9.803 -12.519  -5.174
  606    HD3  PRO  76           HD2      PRO  76   8.109 -12.714  -5.674
  607    H    GLY  77           H        GLY  77   8.522 -15.154  -0.602
  608    HA2  GLY  77           HA3      GLY  77  10.312 -15.354   1.009
  609    HA3  GLY  77           HA2      GLY  77  11.105 -13.961   0.326
  610    H    THR  78           H        THR  78   8.236 -12.793   0.215
  611    HA   THR  78           HA       THR  78   8.355 -11.668   2.922
  612    HB   THR  78           HB       THR  78   8.153 -10.429   0.476
  613    HG1  THR  78           HG1      THR  78   7.188  -9.415   2.962
  614   HG21  THR  78          HG21      THR  78   5.720 -11.192   0.467
  615   HG22  THR  78          HG22      THR  78   6.050  -9.515   0.146
  616   HG23  THR  78          HG23      THR  78   5.441 -10.022   1.730
  617    H    LYS  79           H        LYS  79   6.839 -12.166   4.395
  618    HA   LYS  79           HA       LYS  79   4.426 -13.587   3.497
  619    HB2  LYS  79           HB3      LYS  79   6.155 -14.592   5.181
  620    HB3  LYS  79           HB2      LYS  79   5.358 -13.542   6.345
  621    HG2  LYS  79           HG3      LYS  79   4.575 -15.996   6.074
  622    HG3  LYS  79           HG2      LYS  79   3.379 -14.710   6.254
  623    HD2  LYS  79           HD3      LYS  79   2.834 -16.343   4.456
  624    HD3  LYS  79           HD2      LYS  79   2.973 -14.677   3.886
  625    HE2  LYS  79           HE3      LYS  79   4.071 -16.335   2.399
  626    HE3  LYS  79           HE2      LYS  79   5.167 -15.097   3.011
  627    HZ1  LYS  79           HZ1      LYS  79   6.077 -17.379   3.081
  628    HZ2  LYS  79           HZ2      LYS  79   4.890 -17.798   4.210
  629    HZ3  LYS  79           HZ3      LYS  79   6.051 -16.627   4.588
  630    H    MET  80           H        MET  80   2.519 -13.009   4.099
  631    HA   MET  80           HA       MET  80   2.321 -10.341   5.381
  632    HB2  MET  80           HB3      MET  80   0.658 -11.729   3.362
  633    HB3  MET  80           HB2      MET  80  -0.068 -10.465   4.390
  634    HG2  MET  80           HG3      MET  80   2.437  -9.979   2.795
  635    HG3  MET  80           HG2      MET  80   0.843  -9.830   2.082
  636    HE1  MET  80           HE1      MET  80  -0.442  -8.216   2.000
  637    HE2  MET  80           HE2      MET  80   0.088  -6.547   2.318
  638    HE3  MET  80           HE3      MET  80  -0.988  -7.330   3.423
  639    H    ILE  81           H        ILE  81   1.904 -10.312   6.879
  640    HA   ILE  81           HA       ILE  81   0.290 -12.361   8.613
  641    HB   ILE  81           HB       ILE  81   2.360 -10.474   9.762
  642   HG12  ILE  81          HG13      ILE  81   3.298 -12.981  10.286
  643   HG13  ILE  81          HG12      ILE  81   2.384 -13.339   8.824
  644   HG21  ILE  81          HG21      ILE  81   1.328 -12.783  11.348
  645   HG22  ILE  81          HG22      ILE  81   0.210 -11.416  11.127
  646   HG23  ILE  81          HG23      ILE  81   1.776 -11.165  11.854
  647   HD11  ILE  81          HD11      ILE  81   4.406 -12.867   7.947
  648   HD12  ILE  81          HD12      ILE  81   4.785 -11.662   9.174
  649   HD13  ILE  81          HD13      ILE  81   3.690 -11.274   7.883
  650    H    PHE  82           H        PHE  82  -1.565 -11.881   9.585
  651    HA   PHE  82           HA       PHE  82  -2.957 -10.616  10.711
  652    HB2  PHE  82           HB3      PHE  82  -1.024  -9.082  11.286
  653    HB3  PHE  82           HB2      PHE  82  -1.578  -8.081  10.016
  654    HD1  PHE  82           HD1      PHE  82  -2.111  -9.465  13.316
  655    HD2  PHE  82           HD2      PHE  82  -3.535  -6.782  10.308
  656    HE1  PHE  82           HE1      PHE  82  -3.694  -8.455  14.960
  657    HE2  PHE  82           HE2      PHE  82  -5.113  -5.888  11.890
  658    HZ   PHE  82           HZ       PHE  82  -5.190  -6.704  14.213
  659    H    ALA  83           H        ALA  83  -4.652  -8.963  10.098
  660    HA   ALA  83           HA       ALA  83  -5.180  -7.493   8.034
  661    HB1  ALA  83           HB1      ALA  83  -5.841  -9.300   6.198
  662    HB2  ALA  83           HB2      ALA  83  -4.611 -10.221   6.956
  663    HB3  ALA  83           HB3      ALA  83  -4.255  -8.596   6.255
  664    H    GLY  84           H        GLY  84  -6.853  -7.086   9.437
  665    HA2  GLY  84           HA3      GLY  84  -8.898  -9.077   9.943
  666    HA3  GLY  84           HA2      GLY  84  -8.914  -7.416  10.486
  667    H    ILE  85           H        ILE  85  -8.345  -7.879   7.176
  668    HA   ILE  85           HA       ILE  85 -11.152  -7.550   6.497
  669    HB   ILE  85           HB       ILE  85  -8.890  -5.911   5.406
  670   HG12  ILE  85          HG13      ILE  85 -10.393  -5.511   7.669
  671   HG13  ILE  85          HG12      ILE  85  -9.449  -4.293   6.843
  672   HG21  ILE  85          HG21      ILE  85 -11.812  -5.857   4.667
  673   HG22  ILE  85          HG22      ILE  85 -10.475  -6.499   3.668
  674   HG23  ILE  85          HG23      ILE  85 -10.560  -4.745   4.064
  675   HD11  ILE  85          HD11      ILE  85 -11.579  -3.995   5.408
  676   HD12  ILE  85          HD12      ILE  85 -11.485  -3.238   7.023
  677   HD13  ILE  85          HD13      ILE  85 -12.387  -4.734   6.784
  678    H    LYS  86           H        LYS  86 -11.766  -8.319   4.498
  679    HA   LYS  86           HA       LYS  86  -9.792  -9.578   2.769
  680    HB2  LYS  86           HB3      LYS  86 -11.418 -11.685   2.818
  681    HB3  LYS  86           HB2      LYS  86 -10.076 -11.521   3.941
  682    HG2  LYS  86           HG3      LYS  86 -12.347 -10.225   5.041
  683    HG3  LYS  86           HG2      LYS  86 -12.791 -11.838   4.489
  684    HD2  LYS  86           HD3      LYS  86 -11.322 -12.891   5.956
  685    HD3  LYS  86           HD2      LYS  86 -10.285 -11.502   6.030
  686    HE2  LYS  86           HE3      LYS  86 -12.391 -10.405   7.164
  687    HE3  LYS  86           HE2      LYS  86 -12.825 -12.099   7.507
  688    HZ1  LYS  86           HZ1      LYS  86 -10.150 -11.054   8.198
  689    HZ2  LYS  86           HZ2      LYS  86 -10.916 -12.420   8.814
  690    HZ3  LYS  86           HZ3      LYS  86 -11.431 -10.868   9.254
  691    H    LYS  87           H        LYS  87 -13.172  -8.914   3.441
  692    HA   LYS  87           HA       LYS  87 -14.533  -9.484   1.185
  693    HB2  LYS  87           HB3      LYS  87 -14.848  -7.593   3.261
  694    HB3  LYS  87           HB2      LYS  87 -15.040  -6.672   1.775
  695    HG2  LYS  87           HG3      LYS  87 -17.130  -7.410   1.618
  696    HG3  LYS  87           HG2      LYS  87 -16.488  -9.076   1.431
  697    HD2  LYS  87           HD3      LYS  87 -16.312  -9.186   3.949
  698    HD3  LYS  87           HD2      LYS  87 -17.313  -7.741   4.010
  699    HE2  LYS  87           HE3      LYS  87 -18.631  -9.844   4.222
  700    HE3  LYS  87           HE2      LYS  87 -19.142  -8.809   2.913
  701    HZ1  LYS  87           HZ1      LYS  87 -18.853 -11.334   2.521
  702    HZ2  LYS  87           HZ2      LYS  87 -17.187 -10.968   2.407
  703    HZ3  LYS  87           HZ3      LYS  87 -18.310 -10.246   1.346
  704    H    LYS  88           H        LYS  88 -14.060  -9.329  -0.901
  705    HA   LYS  88           HA       LYS  88 -12.013  -7.893  -2.056
  706    HB2  LYS  88           HB3      LYS  88 -13.144  -9.703  -3.201
  707    HB3  LYS  88           HB2      LYS  88 -14.638  -8.726  -3.288
  708    HG2  LYS  88           HG3      LYS  88 -13.617  -7.214  -4.813
  709    HG3  LYS  88           HG2      LYS  88 -12.042  -7.894  -4.488
  710    HD2  LYS  88           HD3      LYS  88 -14.236  -8.848  -6.230
  711    HD3  LYS  88           HD2      LYS  88 -12.509  -9.008  -6.413
  712    HE2  LYS  88           HE3      LYS  88 -13.437 -11.180  -6.063
  713    HE3  LYS  88           HE2      LYS  88 -12.561 -10.732  -4.684
  714    HZ1  LYS  88           HZ1      LYS  88 -15.203 -11.540  -4.796
  715    HZ2  LYS  88           HZ2      LYS  88 -15.245  -9.846  -4.461
  716    HZ3  LYS  88           HZ3      LYS  88 -14.389 -10.935  -3.442
  717    H    THR  89           H        THR  89 -15.338  -6.895  -1.451
  718    HA   THR  89           HA       THR  89 -15.187  -4.480  -2.837
  719    HB   THR  89           HB       THR  89 -17.315  -4.020  -2.139
  720    HG1  THR  89           HG1      THR  89 -17.208  -3.828   0.003
  721   HG21  THR  89          HG21      THR  89 -17.157  -6.945  -1.500
  722   HG22  THR  89          HG22      THR  89 -17.236  -6.260  -3.161
  723   HG23  THR  89          HG23      THR  89 -18.556  -6.020  -2.066
  724    H    GLU  90           H        GLU  90 -14.232  -5.330   0.310
  725    HA   GLU  90           HA       GLU  90 -14.004  -2.679   1.386
  726    HB2  GLU  90           HB3      GLU  90 -12.786  -5.240   2.378
  727    HB3  GLU  90           HB2      GLU  90 -12.992  -3.754   3.302
  728    HG2  GLU  90           HG3      GLU  90 -15.420  -4.898   2.186
  729    HG3  GLU  90           HG2      GLU  90 -14.666  -5.806   3.439
  730    H    ARG  91           H        ARG  91 -11.844  -5.212   0.235
  731    HA   ARG  91           HA       ARG  91  -9.488  -3.728   0.618
  732    HB2  ARG  91           HB3      ARG  91 -10.008  -5.951  -1.298
  733    HB3  ARG  91           HB2      ARG  91  -8.467  -5.111  -1.179
  734    HG2  ARG  91           HG3      ARG  91  -8.898  -5.721   1.416
  735    HG3  ARG  91           HG2      ARG  91  -9.694  -7.091   0.615
  736    HD2  ARG  91           HD3      ARG  91  -7.056  -6.899  -0.677
  737    HD3  ARG  91           HD2      ARG  91  -6.948  -6.620   1.059
  738    HE   ARG  91           HE       ARG  91  -8.269  -8.743   1.106
  739   HH11  ARG  91          HH11      ARG  91  -5.890  -7.804  -1.257
  740   HH12  ARG  91          HH12      ARG  91  -5.351  -9.355  -1.529
  741   HH21  ARG  91          HH21      ARG  91  -7.586 -10.884   0.710
  742   HH22  ARG  91          HH22      ARG  91  -6.331 -11.187  -0.428
  743    H    GLU  92           H        GLU  92 -11.386  -4.128  -2.230
  744    HA   GLU  92           HA       GLU  92  -9.938  -2.464  -3.925
  745    HB2  GLU  92           HB3      GLU  92 -11.762  -4.080  -4.545
  746    HB3  GLU  92           HB2      GLU  92 -12.902  -2.844  -4.033
  747    HG2  GLU  92           HG3      GLU  92 -12.688  -2.710  -6.413
  748    HG3  GLU  92           HG2      GLU  92 -11.983  -1.270  -5.679
  749    H    ASP  93           H        ASP  93 -12.605  -1.722  -1.698
  750    HA   ASP  93           HA       ASP  93 -13.068   0.906  -2.460
  751    HB2  ASP  93           HB3      ASP  93 -14.628  -0.070  -1.008
  752    HB3  ASP  93           HB2      ASP  93 -13.371  -0.517   0.110
  753    H    GLY  94           H        GLY  94 -10.760  -0.375  -0.104
  754    HA2  GLY  94           HA3      GLY  94  -9.726   1.956   0.788
  755    HA3  GLY  94           HA2      GLY  94  -8.889   0.415   0.816
  756    H    ILE  95           H        ILE  95  -8.896   0.053  -1.893
  757    HA   ILE  95           HA       ILE  95  -6.476   1.241  -2.548
  758    HB   ILE  95           HB       ILE  95  -8.471  -0.390  -3.959
  759   HG12  ILE  95          HG13      ILE  95  -5.465  -0.328  -3.635
  760   HG13  ILE  95          HG12      ILE  95  -6.633  -1.428  -2.825
  761   HG21  ILE  95          HG21      ILE  95  -8.308   0.666  -5.911
  762   HG22  ILE  95          HG22      ILE  95  -6.613   0.150  -5.959
  763   HG23  ILE  95          HG23      ILE  95  -7.057   1.757  -5.348
  764   HD11  ILE  95          HD11      ILE  95  -6.296  -1.372  -5.812
  765   HD12  ILE  95          HD12      ILE  95  -7.012  -2.639  -4.792
  766   HD13  ILE  95          HD13      ILE  95  -5.274  -2.380  -4.743
  767    H    ALA  96           H        ALA  96  -9.857   2.094  -3.327
  768    HA   ALA  96           HA       ALA  96  -9.389   4.000  -5.305
  769    HB1  ALA  96           HB1      ALA  96 -11.591   3.278  -4.786
  770    HB2  ALA  96           HB2      ALA  96 -11.638   4.847  -4.655
  771    HB3  ALA  96           HB3      ALA  96 -11.597   3.748  -3.269
  772    H    TYR  97           H        TYR  97  -9.685   4.239  -1.775
  773    HA   TYR  97           HA       TYR  97  -9.267   7.009  -1.566
  774    HB2  TYR  97           HB3      TYR  97 -10.096   5.858   0.346
  775    HB3  TYR  97           HB2      TYR  97  -8.772   4.714   0.359
  776    HD1  TYR  97           HD1      TYR  97  -7.822   5.042   2.418
  777    HD2  TYR  97           HD2      TYR  97  -8.514   8.357  -0.012
  778    HE1  TYR  97           HE1      TYR  97  -6.565   6.459   3.967
  779    HE2  TYR  97           HE2      TYR  97  -7.287   9.799   1.578
  780    HH   TYR  97           HH       TYR  97  -5.477   8.440   4.219
  781    H    LEU  98           H        LEU  98  -7.078   4.253  -1.773
  782    HA   LEU  98           HA       LEU  98  -4.676   5.593  -1.183
  783    HB2  LEU  98           HB3      LEU  98  -5.442   3.029  -1.836
  784    HB3  LEU  98           HB2      LEU  98  -4.391   3.469  -3.132
  785    HG   LEU  98           HG       LEU  98  -3.550   3.667  -0.253
  786   HD11  LEU  98          HD11      LEU  98  -2.103   1.658  -1.342
  787   HD12  LEU  98          HD12      LEU  98  -3.717   1.370  -2.042
  788   HD13  LEU  98          HD13      LEU  98  -3.496   1.470  -0.265
  789   HD21  LEU  98          HD21      LEU  98  -2.043   3.918  -2.838
  790   HD22  LEU  98          HD22      LEU  98  -1.313   3.697  -1.252
  791   HD23  LEU  98          HD23      LEU  98  -2.283   5.150  -1.580
  792    H    LYS  99           H        LYS  99  -6.519   5.251  -4.131
  793    HA   LYS  99           HA       LYS  99  -4.610   6.106  -5.980
  794    HB2  LYS  99           HB3      LYS  99  -7.563   6.702  -6.154
  795    HB3  LYS  99           HB2      LYS  99  -6.428   6.499  -7.481
  796    HG2  LYS  99           HG3      LYS  99  -7.375   4.358  -5.590
  797    HG3  LYS  99           HG2      LYS  99  -7.827   4.549  -7.285
  798    HD2  LYS  99           HD3      LYS  99  -6.128   2.868  -6.600
  799    HD3  LYS  99           HD2      LYS  99  -5.201   4.442  -7.614
  800    HE2  LYS  99           HE3      LYS  99  -4.007   3.709  -5.891
  801    HE3  LYS  99           HE2      LYS  99  -5.444   3.858  -4.880
  802    HZ1  LYS  99           HZ1      LYS  99  -4.088   1.618  -5.575
  803    HZ2  LYS  99           HZ2      LYS  99  -5.603   1.574  -6.325
  804    HZ3  LYS  99           HZ3      LYS  99  -5.497   1.758  -4.649
  805    H    LYS 100           H        LYS 100  -6.933   7.924  -4.048
  806    HA   LYS 100           HA       LYS 100  -6.108  10.454  -5.178
  807    HB2  LYS 100           HB3      LYS 100  -8.133  10.926  -4.391
  808    HB3  LYS 100           HB2      LYS 100  -8.121   9.520  -3.337
  809    HG2  LYS 100           HG3      LYS 100  -6.832  10.789  -1.683
  810    HG3  LYS 100           HG2      LYS 100  -7.005  12.243  -2.737
  811    HD2  LYS 100           HD3      LYS 100  -9.177  10.683  -1.326
  812    HD3  LYS 100           HD2      LYS 100  -8.685  12.371  -1.023
  813    HE2  LYS 100           HE3      LYS 100  -9.728  11.412  -3.684
  814    HE3  LYS 100           HE2      LYS 100 -10.809  11.997  -2.395
  815    HZ1  LYS 100           HZ1      LYS 100  -9.317  13.475  -4.247
  816    HZ2  LYS 100           HZ2      LYS 100  -8.768  13.867  -2.739
  817    HZ3  LYS 100           HZ3      LYS 100 -10.401  13.982  -3.063
  818    H    ALA 101           H        ALA 101  -5.458   8.576  -2.317
  819    HA   ALA 101           HA       ALA 101  -4.082  10.416  -0.683
  820    HB1  ALA 101           HB1      ALA 101  -3.303   7.552  -0.792
  821    HB2  ALA 101           HB2      ALA 101  -4.888   8.045  -0.195
  822    HB3  ALA 101           HB3      ALA 101  -3.398   8.632   0.611
  823    H    THR 102           H        THR 102  -3.085   8.676  -3.544
  824    HA   THR 102           HA       THR 102  -0.317   9.522  -3.143
  825    HB   THR 102           HB       THR 102  -0.212   7.288  -3.765
  826    HG1  THR 102           HG1      THR 102   0.889   7.435  -5.503
  827   HG21  THR 102          HG21      THR 102  -2.740   7.834  -5.166
  828   HG22  THR 102          HG22      THR 102  -2.135   6.334  -4.439
  829   HG23  THR 102          HG23      THR 102  -1.646   6.810  -6.058
  830    H    ASN 103           H        ASN 103  -3.244  10.024  -4.817
  831    HA   ASN 103           HA       ASN 103  -2.213  12.435  -5.984
  832    HB2  ASN 103           HB3      ASN 103  -3.625  10.759  -7.956
  833    HB3  ASN 103           HB2      ASN 103  -2.388  11.974  -8.224
  834   HD21  ASN 103          HD21      ASN 103  -2.954   8.684  -7.236
  835   HD22  ASN 103          HD22      ASN 103  -1.380   8.084  -7.560
  836    H    GLU 104           H        GLU 104  -3.781  13.906  -5.248
  837    HA   GLU 104           HA       GLU 104  -6.181  14.429  -6.106
  838    HB2  GLU 104           HB3      GLU 104  -6.373  12.068  -4.357
  839    HB3  GLU 104           HB2      GLU 104  -7.665  13.234  -4.203
  840    HG2  GLU 104           HG3      GLU 104  -6.997  12.518  -6.992
  841    HG3  GLU 104           HG2      GLU 104  -7.522  11.127  -6.025
  842    HHA  HEC 201           HHA      HEC 201   5.198  -5.125   0.496
  843    HHB  HEC 201           HHB      HEC 201  -0.375  -2.407   0.351
  844    HHC  HEC 201           HHC      HEC 201  -2.001  -6.060   5.239
  845    HHD  HEC 201           HHD      HEC 201   4.134  -5.825   6.812
  846   HMA1  HEC 201          HMA1      HEC 201   0.964  -1.114  -1.219
  847   HMA2  HEC 201          HMA2      HEC 201   2.573  -0.283  -0.710
  848   HMA3  HEC 201          HMA3      HEC 201   2.374  -1.549  -1.531
  849   HAA1  HEC 201          HAA1      HEC 201   5.041  -2.994  -1.406
  850   HAA2  HEC 201          HAA2      HEC 201   5.635  -2.363   0.134
  851   HBA1  HEC 201          HBA1      HEC 201   4.167  -0.317  -0.267
  852   HBA2  HEC 201          HBA2      HEC 201   3.894  -0.945  -1.904
  853   HMB1  HEC 201          HMB1      HEC 201  -3.544  -1.890   2.060
  854   HMB2  HEC 201          HMB2      HEC 201  -3.638  -3.172   0.837
  855   HMB3  HEC 201          HMB3      HEC 201  -2.369  -1.923   0.724
  856    HAB  HEC 201           HAB      HEC 201  -3.845  -3.219   4.565
  857   HBB1  HEC 201          HBB1      HEC 201  -5.301  -5.183   2.779
  858   HBB2  HEC 201          HBB2      HEC 201  -4.651  -3.689   2.070
  859   HBB3  HEC 201          HBB3      HEC 201  -5.765  -3.603   3.462
  860   HMC1  HEC 201          HMC1      HEC 201  -0.854  -7.530   8.570
  861   HMC2  HEC 201          HMC2      HEC 201  -1.849  -7.662   6.979
  862   HMC3  HEC 201          HMC3      HEC 201  -0.502  -8.290   7.315
  863    HAC  HEC 201           HAC      HEC 201   3.069  -6.829   8.306
  864   HBC1  HEC 201          HBC1      HEC 201   3.342  -9.217   7.749
  865   HBC2  HEC 201          HBC2      HEC 201   1.690  -9.526   8.321
  866   HBC3  HEC 201          HBC3      HEC 201   2.943  -8.976   9.468
  867   HMD1  HEC 201          HMD1      HEC 201   6.057  -7.032   6.402
  868   HMD2  HEC 201          HMD2      HEC 201   7.202  -5.739   5.997
  869   HMD3  HEC 201          HMD3      HEC 201   7.291  -7.306   5.147
  870   HAD1  HEC 201          HAD1      HEC 201   7.989  -6.318   3.167
  871   HAD2  HEC 201          HAD2      HEC 201   7.585  -4.892   2.198
  872   HBD1  HEC 201          HBD1      HEC 201   7.885  -7.557   1.310
  873   HBD2  HEC 201          HBD2      HEC 201   7.346  -6.153   0.369
  Start of MODEL   14
    1    H1   GLY   1          1H        GLY   1 -19.484   3.921  -0.260
    2    H2   GLY   1          2H        GLY   1 -18.859   3.372  -1.747
    3    H3   GLY   1          3H        GLY   1 -19.018   5.030  -1.455
    4    HA2  GLY   1           HA2      GLY   1 -17.380   3.668   0.482
    5    HA3  GLY   1           HA3      GLY   1 -16.745   3.585  -1.166
    6    H    ASP   2           H        ASP   2 -16.645   5.319   1.617
    7    HA   ASP   2           HA       ASP   2 -16.062   7.846   0.268
    8    HB2  ASP   2           HB3      ASP   2 -16.645   7.601   3.167
    9    HB3  ASP   2           HB2      ASP   2 -16.721   9.039   2.217
   10    H    VAL   3           H        VAL   3 -14.303   9.143   1.131
   11    HA   VAL   3           HA       VAL   3 -11.958   7.607   1.433
   12    HB   VAL   3           HB       VAL   3 -12.628  10.523   1.559
   13   HG11  VAL   3          HG11      VAL   3 -11.255  10.599   3.449
   14   HG12  VAL   3          HG12      VAL   3 -10.143  10.878   2.130
   15   HG13  VAL   3          HG13      VAL   3 -10.240   9.279   2.869
   16   HG21  VAL   3          HG21      VAL   3 -11.862  10.203  -0.566
   17   HG22  VAL   3          HG22      VAL   3 -11.145   8.640  -0.174
   18   HG23  VAL   3          HG23      VAL   3 -10.245  10.126   0.134
   19    H    GLU   4           H        GLU   4 -13.962   9.378   3.779
   20    HA   GLU   4           HA       GLU   4 -12.277   9.113   5.950
   21    HB2  GLU   4           HB3      GLU   4 -14.218  10.598   5.982
   22    HB3  GLU   4           HB2      GLU   4 -15.293   9.228   5.781
   23    HG2  GLU   4           HG3      GLU   4 -14.413   8.383   7.976
   24    HG3  GLU   4           HG2      GLU   4 -13.714   9.972   8.223
   25    H    LYS   5           H        LYS   5 -14.841   6.962   4.764
   26    HA   LYS   5           HA       LYS   5 -14.657   5.085   6.852
   27    HB2  LYS   5           HB3      LYS   5 -15.579   4.624   3.958
   28    HB3  LYS   5           HB2      LYS   5 -15.929   3.636   5.358
   29    HG2  LYS   5           HG3      LYS   5 -16.848   6.109   6.152
   30    HG3  LYS   5           HG2      LYS   5 -17.194   6.080   4.451
   31    HD2  LYS   5           HD3      LYS   5 -17.889   3.586   5.818
   32    HD3  LYS   5           HD2      LYS   5 -18.774   5.020   6.356
   33    HE2  LYS   5           HE3      LYS   5 -20.058   4.847   4.556
   34    HE3  LYS   5           HE2      LYS   5 -18.674   5.077   3.525
   35    HZ1  LYS   5           HZ1      LYS   5 -20.214   2.728   3.900
   36    HZ2  LYS   5           HZ2      LYS   5 -18.632   2.436   4.462
   37    HZ3  LYS   5           HZ3      LYS   5 -18.915   2.956   2.872
   38    H    GLY   6           H        GLY   6 -13.038   5.395   3.743
   39    HA2  GLY   6           HA3      GLY   6 -11.780   2.899   3.709
   40    HA3  GLY   6           HA2      GLY   6 -11.183   4.332   2.878
   41    H    LYS   7           H        LYS   7 -10.737   5.997   5.051
   42    HA   LYS   7           HA       LYS   7  -8.141   5.282   5.667
   43    HB2  LYS   7           HB3      LYS   7  -8.510   7.535   5.896
   44    HB3  LYS   7           HB2      LYS   7 -10.053   7.290   6.733
   45    HG2  LYS   7           HG3      LYS   7  -7.861   6.238   8.275
   46    HG3  LYS   7           HG2      LYS   7  -7.527   7.886   7.809
   47    HD2  LYS   7           HD3      LYS   7 -10.162   7.989   8.580
   48    HD3  LYS   7           HD2      LYS   7  -9.444   6.886   9.745
   49    HE2  LYS   7           HE3      LYS   7  -8.904   8.876  10.778
   50    HE3  LYS   7           HE2      LYS   7  -7.609   8.936   9.615
   51    HZ1  LYS   7           HZ1      LYS   7  -8.530  10.932   9.253
   52    HZ2  LYS   7           HZ2      LYS   7 -10.036  10.499   9.749
   53    HZ3  LYS   7           HZ3      LYS   7  -9.500  10.073   8.228
   54    H    LYS   8           H        LYS   8 -11.096   4.886   7.570
   55    HA   LYS   8           HA       LYS   8  -9.901   3.953   9.910
   56    HB2  LYS   8           HB3      LYS   8 -11.992   3.746  10.704
   57    HB3  LYS   8           HB2      LYS   8 -12.370   4.726   9.294
   58    HG2  LYS   8           HG3      LYS   8 -13.935   3.119   9.090
   59    HG3  LYS   8           HG2      LYS   8 -12.662   2.372   8.164
   60    HD2  LYS   8           HD3      LYS   8 -13.947   1.335  10.409
   61    HD3  LYS   8           HD2      LYS   8 -12.608   0.627   9.525
   62    HE2  LYS   8           HE3      LYS   8 -11.073   1.930  10.884
   63    HE3  LYS   8           HE2      LYS   8 -12.439   2.523  11.850
   64    HZ1  LYS   8           HZ1      LYS   8 -11.140  -0.087  11.864
   65    HZ2  LYS   8           HZ2      LYS   8 -12.826  -0.112  11.992
   66    HZ3  LYS   8           HZ3      LYS   8 -11.904   0.736  13.129
   67    H    ILE   9           H        ILE   9 -11.275   2.328   7.096
   68    HA   ILE   9           HA       ILE   9 -11.025  -0.312   8.014
   69    HB   ILE   9           HB       ILE   9 -11.201   0.917   5.290
   70   HG12  ILE   9          HG13      ILE   9 -12.895  -1.031   6.866
   71   HG13  ILE   9          HG12      ILE   9 -13.256   0.663   6.553
   72   HG21  ILE   9          HG21      ILE   9 -10.934  -1.130   4.173
   73   HG22  ILE   9          HG22      ILE   9 -10.968  -2.051   5.674
   74   HG23  ILE   9          HG23      ILE   9  -9.573  -1.044   5.292
   75   HD11  ILE   9          HD11      ILE   9 -13.259   0.044   4.093
   76   HD12  ILE   9          HD12      ILE   9 -14.600  -0.548   5.073
   77   HD13  ILE   9          HD13      ILE   9 -13.283  -1.636   4.634
   78    H    PHE  10           H        PHE  10  -8.843   1.502   6.383
   79    HA   PHE  10           HA       PHE  10  -7.005  -0.625   6.162
   80    HB2  PHE  10           HB3      PHE  10  -6.469   0.798   4.506
   81    HB3  PHE  10           HB2      PHE  10  -7.161   2.176   5.346
   82    HD1  PHE  10           HD1      PHE  10  -4.185   1.176   3.733
   83    HD2  PHE  10           HD2      PHE  10  -5.710   3.071   7.151
   84    HE1  PHE  10           HE1      PHE  10  -1.903   1.817   4.337
   85    HE2  PHE  10           HE2      PHE  10  -3.432   3.719   7.762
   86    HZ   PHE  10           HZ       PHE  10  -1.526   3.090   6.354
   87    H    VAL  11           H        VAL  11  -7.334   1.957   8.381
   88    HA   VAL  11           HA       VAL  11  -4.859   1.944   9.571
   89    HB   VAL  11           HB       VAL  11  -7.551   2.452  10.826
   90   HG11  VAL  11          HG11      VAL  11  -6.529   3.292  12.747
   91   HG12  VAL  11          HG12      VAL  11  -4.940   3.357  11.988
   92   HG13  VAL  11          HG13      VAL  11  -5.644   1.801  12.421
   93   HG21  VAL  11          HG21      VAL  11  -7.441   4.378   9.728
   94   HG22  VAL  11          HG22      VAL  11  -5.866   3.940   9.064
   95   HG23  VAL  11          HG23      VAL  11  -5.968   4.776  10.613
   96    H    GLN  12           H        GLN  12  -7.722   0.144  10.647
   97    HA   GLN  12           HA       GLN  12  -6.047  -1.293  12.651
   98    HB2  GLN  12           HB3      GLN  12  -8.188  -2.676  12.953
   99    HB3  GLN  12           HB2      GLN  12  -8.250  -1.010  13.387
  100    HG2  GLN  12           HG3      GLN  12 -10.004  -0.876  12.038
  101    HG3  GLN  12           HG2      GLN  12  -8.984  -1.007  10.738
  102   HE21  GLN  12          HE21      GLN  12  -8.238  -3.728  11.360
  103   HE22  GLN  12          HE22      GLN  12  -9.628  -4.719  10.967
  104    H    LYS  13           H        LYS  13  -7.720  -1.868   9.760
  105    HA   LYS  13           HA       LYS  13  -7.619  -4.135   8.528
  106    HB2  LYS  13           HB3      LYS  13  -8.014  -2.386   7.160
  107    HB3  LYS  13           HB2      LYS  13  -6.619  -1.451   7.629
  108    HG2  LYS  13           HG3      LYS  13  -6.129  -2.156   5.490
  109    HG3  LYS  13           HG2      LYS  13  -5.269  -3.282   6.492
  110    HD2  LYS  13           HD3      LYS  13  -6.395  -5.072   5.569
  111    HD3  LYS  13           HD2      LYS  13  -7.929  -4.307   5.985
  112    HE2  LYS  13           HE3      LYS  13  -7.074  -2.821   3.842
  113    HE3  LYS  13           HE2      LYS  13  -6.757  -4.627   3.427
  114    HZ1  LYS  13           HZ1      LYS  13  -9.321  -3.915   4.311
  115    HZ2  LYS  13           HZ2      LYS  13  -8.720  -5.215   3.464
  116    HZ3  LYS  13           HZ3      LYS  13  -8.888  -3.756   2.712
  117    H    CYS  14           H        CYS  14  -4.587  -2.321   8.931
  118    HA   CYS  14           HA       CYS  14  -2.922  -4.416   9.556
  119    HB2  CYS  14           HB3      CYS  14  -1.550  -4.854   7.676
  120    HB3  CYS  14           HB2      CYS  14  -3.222  -5.519   7.521
  121    H    ALA  15           H        ALA  15  -3.567  -1.309   9.522
  122    HA   ALA  15           HA       ALA  15  -1.332   0.073   8.620
  123    HB1  ALA  15           HB1      ALA  15  -2.732   0.788  11.201
  124    HB2  ALA  15           HB2      ALA  15  -3.516   0.945   9.590
  125    HB3  ALA  15           HB3      ALA  15  -2.038   1.839   9.939
  126    H    GLN  16           H        GLN  16  -1.453  -2.170  11.589
  127    HA   GLN  16           HA       GLN  16   0.806  -1.202  12.945
  128    HB2  GLN  16           HB3      GLN  16   0.470  -4.119  12.913
  129    HB3  GLN  16           HB2      GLN  16   0.540  -2.995  14.264
  130    HG2  GLN  16           HG3      GLN  16  -1.854  -2.335  13.608
  131    HG3  GLN  16           HG2      GLN  16  -1.855  -3.749  12.603
  132   HE21  GLN  16          HE21      GLN  16  -0.669  -3.038  15.841
  133   HE22  GLN  16          HE22      GLN  16  -1.531  -4.322  16.649
  134    H    CYS  17           H        CYS  17   0.566  -3.382  10.203
  135    HA   CYS  17           HA       CYS  17   3.386  -4.070  10.178
  136    HB2  CYS  17           HB3      CYS  17   1.556  -4.353   7.849
  137    HB3  CYS  17           HB2      CYS  17   2.945  -5.334   8.278
  138    H    HIS  18           H        HIS  18   1.482  -1.472   9.019
  139    HA   HIS  18           HA       HIS  18   3.700  -0.588   7.308
  140    HB2  HIS  18           HB3      HIS  18   0.804   0.271   7.215
  141    HB3  HIS  18           HB2      HIS  18   2.076   0.785   6.112
  142    HD1  HIS  18           HD1      HIS  18   1.804  -0.325   3.957
  143    HD2  HIS  18           HD2      HIS  18   0.822  -2.832   7.089
  144    HE1  HIS  18           HE1      HIS  18   1.187  -2.551   2.892
  145    H    THR  19           H        THR  19   3.188  -0.305  10.292
  146    HA   THR  19           HA       THR  19   3.336   1.297  11.943
  147    HB   THR  19           HB       THR  19   4.844   2.815   9.791
  148    HG1  THR  19           HG1      THR  19   6.650   1.686  10.534
  149   HG21  THR  19          HG21      THR  19   5.277   2.882  12.763
  150   HG22  THR  19          HG22      THR  19   4.366   4.073  11.851
  151   HG23  THR  19          HG23      THR  19   6.080   3.828  11.519
  152    H    VAL  20           H        VAL  20   2.689   3.436  12.681
  153    HA   VAL  20           HA       VAL  20   0.295   4.357  11.313
  154    HB   VAL  20           HB       VAL  20   1.427   5.606  13.772
  155   HG11  VAL  20          HG11      VAL  20  -0.730   6.320  12.483
  156   HG12  VAL  20          HG12      VAL  20  -0.789   6.225  14.203
  157   HG13  VAL  20          HG13      VAL  20  -1.432   4.891  13.266
  158   HG21  VAL  20          HG21      VAL  20   0.379   3.942  15.134
  159   HG22  VAL  20          HG22      VAL  20   1.578   3.185  14.127
  160   HG23  VAL  20          HG23      VAL  20  -0.139   3.031  13.750
  161    H    GLU  21           H        GLU  21   0.848   7.034  12.676
  162    HA   GLU  21           HA       GLU  21   1.611   8.437  10.375
  163    HB2  GLU  21           HB3      GLU  21   1.947  10.000  12.793
  164    HB3  GLU  21           HB2      GLU  21   0.814  10.224  11.461
  165    HG2  GLU  21           HG3      GLU  21  -0.673   8.546  12.514
  166    HG3  GLU  21           HG2      GLU  21   0.516   8.339  13.828
  167    H    LYS  22           H        LYS  22   3.465   9.562   9.836
  168    HA   LYS  22           HA       LYS  22   5.939   8.388  10.358
  169    HB2  LYS  22           HB3      LYS  22   5.272  10.089   8.500
  170    HB3  LYS  22           HB2      LYS  22   5.696  11.326   9.675
  171    HG2  LYS  22           HG3      LYS  22   7.468   9.230   8.511
  172    HG3  LYS  22           HG2      LYS  22   7.574  10.985   8.259
  173    HD2  LYS  22           HD3      LYS  22   8.040   9.494  10.830
  174    HD3  LYS  22           HD2      LYS  22   9.281  10.226   9.833
  175    HE2  LYS  22           HE3      LYS  22   8.363  12.421  10.301
  176    HE3  LYS  22           HE2      LYS  22   6.963  11.714  11.151
  177    HZ1  LYS  22           HZ1      LYS  22   9.455  12.451  12.190
  178    HZ2  LYS  22           HZ2      LYS  22   9.342  10.765  12.337
  179    HZ3  LYS  22           HZ3      LYS  22   8.165  11.775  13.010
  180    H    GLY  23           H        GLY  23   7.158   8.293  12.063
  181    HA2  GLY  23           HA3      GLY  23   8.323  10.163  13.553
  182    HA3  GLY  23           HA2      GLY  23   6.690  10.193  14.241
  183    H    GLY  24           H        GLY  24   6.219   7.356  13.837
  184    HA2  GLY  24           HA3      GLY  24   7.376   6.400  16.300
  185    HA3  GLY  24           HA2      GLY  24   6.274   5.539  15.272
  186    H    LYS  25           H        LYS  25   7.160   3.624  14.795
  187    HA   LYS  25           HA       LYS  25  10.053   3.637  14.066
  188    HB2  LYS  25           HB3      LYS  25   8.836   0.990  14.505
  189    HB3  LYS  25           HB2      LYS  25  10.297   1.729  15.254
  190    HG2  LYS  25           HG3      LYS  25   9.158   2.432  17.067
  191    HG3  LYS  25           HG2      LYS  25   7.656   2.685  16.193
  192    HD2  LYS  25           HD3      LYS  25   8.823   0.070  17.029
  193    HD3  LYS  25           HD2      LYS  25   7.440   0.844  17.764
  194    HE2  LYS  25           HE3      LYS  25   6.112  -0.131  16.241
  195    HE3  LYS  25           HE2      LYS  25   7.021   0.613  14.906
  196    HZ1  LYS  25           HZ1      LYS  25   7.071  -2.070  15.902
  197    HZ2  LYS  25           HZ2      LYS  25   8.583  -1.456  15.722
  198    HZ3  LYS  25           HZ3      LYS  25   7.549  -1.491  14.386
  199    H    HIS  26           H        HIS  26  10.721   2.221  12.328
  200    HA   HIS  26           HA       HIS  26   9.120   2.572  10.005
  201    HB2  HIS  26           HB3      HIS  26  11.038   0.452   9.625
  202    HB3  HIS  26           HB2      HIS  26  11.096   2.088   9.034
  203    HD1  HIS  26           HD1      HIS  26  11.774   0.407  12.351
  204    HD2  HIS  26           HD2      HIS  26  13.366   3.309   9.873
  205    HE1  HIS  26           HE1      HIS  26  13.868   1.180  13.467
  206    HE2  HIS  26           HE2      HIS  26  14.778   3.021  12.020
  207    H    LYS  27           H        LYS  27   7.841   1.170   8.889
  208    HA   LYS  27           HA       LYS  27   6.752  -1.070  10.376
  209    HB2  LYS  27           HB3      LYS  27   4.908  -0.911   8.983
  210    HB3  LYS  27           HB2      LYS  27   5.504   0.705   8.943
  211    HG2  LYS  27           HG3      LYS  27   6.856  -0.531   6.845
  212    HG3  LYS  27           HG2      LYS  27   5.232  -1.203   6.828
  213    HD2  LYS  27           HD3      LYS  27   5.701   0.956   5.504
  214    HD3  LYS  27           HD2      LYS  27   4.236   0.874   6.487
  215    HE2  LYS  27           HE3      LYS  27   4.905   2.583   7.742
  216    HE3  LYS  27           HE2      LYS  27   6.458   1.830   7.998
  217    HZ1  LYS  27           HZ1      LYS  27   7.268   2.868   6.019
  218    HZ2  LYS  27           HZ2      LYS  27   6.438   4.085   6.850
  219    HZ3  LYS  27           HZ3      LYS  27   5.711   3.292   5.531
  220    H    THR  28           H        THR  28   6.162  -3.080   8.950
  221    HA   THR  28           HA       THR  28   8.588  -4.285   8.141
  222    HB   THR  28           HB       THR  28   5.936  -5.447   7.348
  223    HG1  THR  28           HG1      THR  28   6.770  -5.541  10.003
  224   HG21  THR  28          HG21      THR  28   6.883  -7.541   7.878
  225   HG22  THR  28          HG22      THR  28   8.078  -6.769   8.995
  226   HG23  THR  28          HG23      THR  28   8.264  -6.628   7.236
  227    H    GLY  29           H        GLY  29   5.808  -2.925   6.392
  228    HA2  GLY  29           HA3      GLY  29   7.427  -3.031   3.933
  229    HA3  GLY  29           HA2      GLY  29   5.790  -3.553   3.919
  230    HA   PRO  30           HA       PRO  30   6.683   1.232   3.226
  231    HB2  PRO  30           HB3      PRO  30   5.600   0.331   0.577
  232    HB3  PRO  30           HB2      PRO  30   6.755   1.643   0.925
  233    HG2  PRO  30           HG3      PRO  30   7.613  -0.695   0.017
  234    HG3  PRO  30           HG2      PRO  30   8.547   0.209   1.239
  235    HD2  PRO  30           HD3      PRO  30   6.931  -2.307   1.544
  236    HD3  PRO  30           HD2      PRO  30   8.333  -1.706   2.476
  237    H    ASN  31           H        ASN  31   5.046   2.306   4.134
  238    HA   ASN  31           HA       ASN  31   2.468   1.318   4.525
  239    HB2  ASN  31           HB3      ASN  31   3.752   3.411   5.534
  240    HB3  ASN  31           HB2      ASN  31   2.840   4.282   4.300
  241   HD21  ASN  31          HD21      ASN  31   2.128   5.170   6.547
  242   HD22  ASN  31          HD22      ASN  31   0.681   4.430   7.218
  243    H    LEU  32           H        LEU  32   3.398   3.950   2.253
  244    HA   LEU  32           HA       LEU  32   1.917   2.889   0.151
  245    HB2  LEU  32           HB3      LEU  32   0.020   4.398  -0.112
  246    HB3  LEU  32           HB2      LEU  32  -0.016   3.438   1.357
  247    HG   LEU  32           HG       LEU  32  -1.066   5.567   1.920
  248   HD11  LEU  32          HD11      LEU  32   1.598   5.195   2.861
  249   HD12  LEU  32          HD12      LEU  32   0.171   4.514   3.640
  250   HD13  LEU  32          HD13      LEU  32   0.438   6.256   3.661
  251   HD21  LEU  32          HD21      LEU  32  -0.293   7.529   1.158
  252   HD22  LEU  32          HD22      LEU  32   0.377   6.453  -0.068
  253   HD23  LEU  32          HD23      LEU  32   1.368   6.971   1.302
  254    H    HIS  33           H        HIS  33   3.421   5.599   1.686
  255    HA   HIS  33           HA       HIS  33   3.527   7.586  -0.207
  256    HB2  HIS  33           HB3      HIS  33   4.822   7.059   2.240
  257    HB3  HIS  33           HB2      HIS  33   6.123   7.251   1.070
  258    HD1  HIS  33           HD1      HIS  33   6.748   9.511   2.230
  259    HD2  HIS  33           HD2      HIS  33   2.998   9.464   0.487
  260    HE1  HIS  33           HE1      HIS  33   6.032  11.920   2.145
  261    HE2  HIS  33           HE2      HIS  33   3.675  11.853   1.157
  262    H    GLY  34           H        GLY  34   4.274   7.687  -2.187
  263    HA2  GLY  34           HA3      GLY  34   5.591   7.330  -4.069
  264    HA3  GLY  34           HA2      GLY  34   6.743   6.508  -2.995
  265    H    LEU  35           H        LEU  35   3.518   5.324  -2.823
  266    HA   LEU  35           HA       LEU  35   4.259   2.743  -3.657
  267    HB2  LEU  35           HB3      LEU  35   2.320   3.290  -2.187
  268    HB3  LEU  35           HB2      LEU  35   1.489   3.921  -3.596
  269    HG   LEU  35           HG       LEU  35   1.419   1.752  -4.612
  270   HD11  LEU  35          HD11      LEU  35   2.553  -0.124  -3.900
  271   HD12  LEU  35          HD12      LEU  35   2.396   0.355  -2.186
  272   HD13  LEU  35          HD13      LEU  35   3.604   1.149  -3.237
  273   HD21  LEU  35          HD21      LEU  35   0.354   2.039  -1.797
  274   HD22  LEU  35          HD22      LEU  35   0.066   0.575  -2.679
  275   HD23  LEU  35          HD23      LEU  35  -0.540   2.096  -3.341
  276    H    PHE  36           H        PHE  36   2.445   5.266  -5.399
  277    HA   PHE  36           HA       PHE  36   2.842   3.754  -7.870
  278    HB2  PHE  36           HB3      PHE  36   0.916   6.059  -7.786
  279    HB3  PHE  36           HB2      PHE  36   0.806   4.526  -8.646
  280    HD1  PHE  36           HD1      PHE  36  -0.281   2.632  -7.708
  281    HD2  PHE  36           HD2      PHE  36   0.273   6.197  -5.389
  282    HE1  PHE  36           HE1      PHE  36  -1.808   1.742  -6.015
  283    HE2  PHE  36           HE2      PHE  36  -1.245   5.352  -3.706
  284    HZ   PHE  36           HZ       PHE  36  -2.332   3.137  -3.966
  285    H    GLY  37           H        GLY  37   4.583   5.815  -6.337
  286    HA2  GLY  37           HA3      GLY  37   5.128   7.501  -8.704
  287    HA3  GLY  37           HA2      GLY  37   5.215   8.100  -7.078
  288    H    ARG  38           H        ARG  38   6.458   5.793  -5.899
  289    HA   ARG  38           HA       ARG  38   9.161   6.225  -6.840
  290    HB2  ARG  38           HB3      ARG  38   8.050   4.839  -4.424
  291    HB3  ARG  38           HB2      ARG  38   9.778   4.959  -4.799
  292    HG2  ARG  38           HG3      ARG  38   9.484   7.482  -4.824
  293    HG3  ARG  38           HG2      ARG  38   7.923   7.151  -4.064
  294    HD2  ARG  38           HD3      ARG  38   8.876   6.900  -2.075
  295    HD3  ARG  38           HD2      ARG  38   9.986   5.659  -2.710
  296    HE   ARG  38           HE       ARG  38  11.597   7.208  -2.436
  297   HH11  ARG  38          HH11      ARG  38   8.661   8.853  -3.482
  298   HH12  ARG  38          HH12      ARG  38   9.394  10.405  -3.547
  299   HH21  ARG  38          HH21      ARG  38  12.586   9.303  -2.565
  300   HH22  ARG  38          HH22      ARG  38  11.609  10.664  -3.026
  301    H    LYS  39           H        LYS  39  10.665   4.292  -6.828
  302    HA   LYS  39           HA       LYS  39   9.909   2.556  -8.860
  303    HB2  LYS  39           HB3      LYS  39  12.225   3.002  -8.246
  304    HB3  LYS  39           HB2      LYS  39  11.992   2.054  -6.746
  305    HG2  LYS  39           HG3      LYS  39  12.976   1.075  -9.089
  306    HG3  LYS  39           HG2      LYS  39  12.294   0.115  -7.786
  307    HD2  LYS  39           HD3      LYS  39  11.326  -0.485  -9.945
  308    HD3  LYS  39           HD2      LYS  39  10.078   0.235  -8.866
  309    HE2  LYS  39           HE3      LYS  39  10.710   2.440 -10.063
  310    HE3  LYS  39           HE2      LYS  39  11.486   1.427 -11.277
  311    HZ1  LYS  39           HZ1      LYS  39   9.515   0.684 -12.016
  312    HZ2  LYS  39           HZ2      LYS  39   8.961   2.147 -11.443
  313    HZ3  LYS  39           HZ3      LYS  39   8.757   0.771 -10.505
  314    H    THR  40           H        THR  40  11.009   0.890  -6.013
  315    HA   THR  40           HA       THR  40   8.403  -0.018  -5.191
  316    HB   THR  40           HB       THR  40   8.902  -2.286  -4.964
  317    HG1  THR  40           HG1      THR  40  10.382  -3.481  -5.868
  318   HG21  THR  40          HG21      THR  40   8.580  -2.044  -7.715
  319   HG22  THR  40          HG22      THR  40   8.866  -2.881  -6.504
  320   HG23  THR  40          HG23      THR  40   7.475  -2.899  -6.201
  321    H    GLY  41           H        GLY  41   8.307   0.345  -3.426
  322    HA2  GLY  41           HA3      GLY  41   8.824   0.345  -1.181
  323    HA3  GLY  41           HA2      GLY  41   9.461  -1.229  -1.456
  324    H    GLN  42           H        GLN  42  10.687   1.785  -2.837
  325    HA   GLN  42           HA       GLN  42  13.235   1.214  -1.476
  326    HB2  GLN  42           HB3      GLN  42  13.773   3.265  -3.216
  327    HB3  GLN  42           HB2      GLN  42  14.022   1.597  -3.576
  328    HG2  GLN  42           HG3      GLN  42  12.758   2.764  -5.332
  329    HG3  GLN  42           HG2      GLN  42  11.879   1.414  -4.640
  330   HE21  GLN  42          HE21      GLN  42   9.792   1.953  -4.677
  331   HE22  GLN  42          HE22      GLN  42   9.116   3.456  -4.159
  332    H    ALA  43           H        ALA  43  11.316   2.294   0.171
  333    HA   ALA  43           HA       ALA  43  11.155   5.029   0.434
  334    HB1  ALA  43           HB1      ALA  43  11.243   4.107   3.025
  335    HB2  ALA  43           HB2      ALA  43  10.690   2.755   2.130
  336    HB3  ALA  43           HB3      ALA  43   9.814   4.235   1.994
  337    HA   PRO  44           HA       PRO  44  14.980   6.498   1.997
  338    HB2  PRO  44           HB3      PRO  44  14.383   8.115   4.002
  339    HB3  PRO  44           HB2      PRO  44  13.889   8.485   2.356
  340    HG2  PRO  44           HG3      PRO  44  12.270   7.325   4.607
  341    HG3  PRO  44           HG2      PRO  44  11.821   8.542   3.417
  342    HD2  PRO  44           HD3      PRO  44  11.130   5.874   3.263
  343    HD3  PRO  44           HD2      PRO  44  11.253   6.962   1.867
  344    H    GLY  45           H        GLY  45  14.069   6.997   5.206
  345    HA2  GLY  45           HA3      GLY  45  16.099   5.274   6.218
  346    HA3  GLY  45           HA2      GLY  45  14.959   6.222   7.156
  347    H    PHE  46           H        PHE  46  13.289   4.400   4.967
  348    HA   PHE  46           HA       PHE  46  12.330   2.597   7.013
  349    HB2  PHE  46           HB3      PHE  46  10.760   3.644   5.453
  350    HB3  PHE  46           HB2      PHE  46  11.523   2.854   4.071
  351    HD1  PHE  46           HD1      PHE  46   9.709   2.124   7.258
  352    HD2  PHE  46           HD2      PHE  46  10.882   0.761   3.381
  353    HE1  PHE  46           HE1      PHE  46   8.279   0.154   7.523
  354    HE2  PHE  46           HE2      PHE  46   9.455  -1.211   3.638
  355    HZ   PHE  46           HZ       PHE  46   8.135  -1.521   5.723
  356    H    THR  47           H        THR  47  12.750   0.437   7.191
  357    HA   THR  47           HA       THR  47  14.973  -0.604   5.641
  358    HB   THR  47           HB       THR  47  14.026  -1.004   8.207
  359    HG1  THR  47           HG1      THR  47  15.686  -2.527   8.292
  360   HG21  THR  47          HG21      THR  47  13.651  -3.482   8.329
  361   HG22  THR  47          HG22      THR  47  13.408  -3.453   6.588
  362   HG23  THR  47          HG23      THR  47  12.301  -2.551   7.641
  363    H    TYR  48           H        TYR  48  14.415  -1.106   3.602
  364    HA   TYR  48           HA       TYR  48  11.904  -2.231   2.849
  365    HB2  TYR  48           HB3      TYR  48  13.860  -2.756   0.839
  366    HB3  TYR  48           HB2      TYR  48  12.564  -1.541   0.892
  367    HD1  TYR  48           HD1      TYR  48  16.030  -2.133   2.187
  368    HD2  TYR  48           HD2      TYR  48  13.219   0.695   0.748
  369    HE1  TYR  48           HE1      TYR  48  17.744  -0.406   2.358
  370    HE2  TYR  48           HE2      TYR  48  14.905   2.474   0.900
  371    HH   TYR  48           HH       TYR  48  17.999   1.903   2.390
  372    H    THR  49           H        THR  49  11.653  -4.277   1.759
  373    HA   THR  49           HA       THR  49  12.880  -6.438   3.188
  374    HB   THR  49           HB       THR  49  11.305  -7.864   2.089
  375    HG1  THR  49           HG1      THR  49   9.870  -6.799   0.526
  376   HG21  THR  49          HG21      THR  49   9.376  -5.704   2.285
  377   HG22  THR  49          HG22      THR  49  10.508  -5.720   3.637
  378   HG23  THR  49          HG23      THR  49   9.563  -7.125   3.258
  379    H    ASP  50           H        ASP  50  13.546  -8.408   1.829
  380    HA   ASP  50           HA       ASP  50  15.817  -7.772   0.381
  381    HB2  ASP  50           HB3      ASP  50  15.874  -9.965   1.051
  382    HB3  ASP  50           HB2      ASP  50  14.183 -10.216   0.632
  383    H    ALA  51           H        ALA  51  12.520  -8.234  -0.712
  384    HA   ALA  51           HA       ALA  51  13.120  -8.171  -3.498
  385    HB1  ALA  51           HB1      ALA  51  10.996  -8.781  -3.585
  386    HB2  ALA  51           HB2      ALA  51  10.441  -7.248  -2.949
  387    HB3  ALA  51           HB3      ALA  51  10.839  -8.588  -1.855
  388    H    ASN  52           H        ASN  52  12.021  -5.733  -1.139
  389    HA   ASN  52           HA       ASN  52  11.723  -3.619  -2.957
  390    HB2  ASN  52           HB3      ASN  52  12.444  -3.517  -0.031
  391    HB3  ASN  52           HB2      ASN  52  11.922  -2.167  -0.974
  392   HD21  ASN  52          HD21      ASN  52  10.137  -4.193  -2.465
  393   HD22  ASN  52          HD22      ASN  52   8.758  -4.257  -1.463
  394    H    LYS  53           H        LYS  53  14.488  -4.597  -1.037
  395    HA   LYS  53           HA       LYS  53  16.247  -2.596  -1.742
  396    HB2  LYS  53           HB3      LYS  53  18.038  -4.242  -1.197
  397    HB3  LYS  53           HB2      LYS  53  16.864  -3.981   0.030
  398    HG2  LYS  53           HG3      LYS  53  15.731  -5.997  -0.411
  399    HG3  LYS  53           HG2      LYS  53  16.704  -6.281  -1.849
  400    HD2  LYS  53           HD3      LYS  53  17.843  -7.627  -0.429
  401    HD3  LYS  53           HD2      LYS  53  18.695  -6.114  -0.177
  402    HE2  LYS  53           HE3      LYS  53  18.178  -6.189   1.978
  403    HE3  LYS  53           HE2      LYS  53  16.502  -6.076   1.536
  404    HZ1  LYS  53           HZ1      LYS  53  17.996  -8.328   2.513
  405    HZ2  LYS  53           HZ2      LYS  53  17.160  -8.661   1.083
  406    HZ3  LYS  53           HZ3      LYS  53  16.296  -8.072   2.459
  407    H    ASN  54           H        ASN  54  15.275  -5.453  -3.425
  408    HA   ASN  54           HA       ASN  54  17.325  -5.303  -5.420
  409    HB2  ASN  54           HB3      ASN  54  14.687  -6.788  -5.414
  410    HB3  ASN  54           HB2      ASN  54  15.975  -7.061  -6.573
  411   HD21  ASN  54          HD21      ASN  54  17.316  -6.334  -3.666
  412   HD22  ASN  54          HD22      ASN  54  17.617  -7.920  -3.056
  413    H    LYS  55           H        LYS  55  14.367  -3.702  -4.847
  414    HA   LYS  55           HA       LYS  55  13.344  -1.998  -5.966
  415    HB2  LYS  55           HB3      LYS  55  15.642  -2.453  -7.857
  416    HB3  LYS  55           HB2      LYS  55  14.377  -1.284  -8.202
  417    HG2  LYS  55           HG3      LYS  55  15.189   0.192  -6.725
  418    HG3  LYS  55           HG2      LYS  55  15.513  -1.062  -5.514
  419    HD2  LYS  55           HD3      LYS  55  17.255  -0.243  -7.843
  420    HD3  LYS  55           HD2      LYS  55  17.654  -0.185  -6.145
  421    HE2  LYS  55           HE3      LYS  55  17.234  -2.728  -6.261
  422    HE3  LYS  55           HE2      LYS  55  17.552  -2.426  -7.991
  423    HZ1  LYS  55           HZ1      LYS  55  19.605  -2.982  -7.097
  424    HZ2  LYS  55           HZ2      LYS  55  19.364  -2.011  -5.703
  425    HZ3  LYS  55           HZ3      LYS  55  19.652  -1.287  -7.240
  426    H    GLY  56           H        GLY  56  11.911  -4.038  -5.990
  427    HA2  GLY  56           HA3      GLY  56  11.487  -5.510  -8.300
  428    HA3  GLY  56           HA2      GLY  56  10.233  -5.109  -7.143
  429    H    ILE  57           H        ILE  57   8.658  -3.732  -7.781
  430    HA   ILE  57           HA       ILE  57   9.130  -1.866  -9.953
  431    HB   ILE  57           HB       ILE  57   8.004  -4.301 -10.586
  432   HG12  ILE  57          HG13      ILE  57   8.851  -3.167 -12.310
  433   HG13  ILE  57          HG12      ILE  57   7.184  -2.805 -12.624
  434   HG21  ILE  57          HG21      ILE  57   5.891  -3.945  -9.577
  435   HG22  ILE  57          HG22      ILE  57   5.675  -3.540 -11.264
  436   HG23  ILE  57          HG23      ILE  57   5.860  -2.269 -10.099
  437   HD11  ILE  57          HD11      ILE  57   7.385  -0.613 -12.023
  438   HD12  ILE  57          HD12      ILE  57   9.073  -0.936 -12.576
  439   HD13  ILE  57          HD13      ILE  57   8.659  -0.962 -10.859
  440    H    THR  58           H        THR  58   7.174  -0.483 -10.387
  441    HA   THR  58           HA       THR  58   6.264   0.564  -7.869
  442    HB   THR  58           HB       THR  58   6.743   1.589 -10.406
  443    HG1  THR  58           HG1      THR  58   6.226   3.524  -9.386
  444   HG21  THR  58          HG21      THR  58   4.351   1.052 -10.964
  445   HG22  THR  58          HG22      THR  58   4.755   2.783 -11.009
  446   HG23  THR  58          HG23      THR  58   3.895   2.123  -9.588
  447    H    TRP  59           H        TRP  59   4.625  -0.208  -6.850
  448    HA   TRP  59           HA       TRP  59   2.648  -1.869  -7.985
  449    HB2  TRP  59           HB3      TRP  59   1.992  -0.540  -5.418
  450    HB3  TRP  59           HB2      TRP  59   1.984  -2.235  -5.855
  451    HD1  TRP  59           HD1      TRP  59   4.404   0.534  -4.831
  452    HE1  TRP  59           HE1      TRP  59   6.474  -0.583  -3.691
  453    HE3  TRP  59           HE3      TRP  59   3.255  -4.384  -5.628
  454    HZ2  TRP  59           HZ2      TRP  59   7.427  -3.178  -3.211
  455    HZ3  TRP  59           HZ3      TRP  59   4.769  -6.123  -4.784
  456    HH2  TRP  59           HH2      TRP  59   6.831  -5.515  -3.640
  457    H    LYS  60           H        LYS  60   1.258  -1.237  -9.464
  458    HA   LYS  60           HA       LYS  60   0.044   1.429  -9.115
  459    HB2  LYS  60           HB3      LYS  60   0.376   1.572 -11.358
  460    HB3  LYS  60           HB2      LYS  60   0.975  -0.068 -11.370
  461    HG2  LYS  60           HG3      LYS  60  -0.759  -0.398 -12.774
  462    HG3  LYS  60           HG2      LYS  60  -1.678  -0.510 -11.295
  463    HD2  LYS  60           HD3      LYS  60  -2.761   1.362 -11.643
  464    HD3  LYS  60           HD2      LYS  60  -1.325   2.241 -12.149
  465    HE2  LYS  60           HE3      LYS  60  -1.956   0.313 -14.182
  466    HE3  LYS  60           HE2      LYS  60  -3.457   1.202 -13.775
  467    HZ1  LYS  60           HZ1      LYS  60  -1.527   2.038 -15.450
  468    HZ2  LYS  60           HZ2      LYS  60  -1.133   2.895 -14.061
  469    HZ3  LYS  60           HZ3      LYS  60  -2.701   3.023 -14.731
  470    H    GLU  61           H        GLU  61  -2.312   1.466  -9.976
  471    HA   GLU  61           HA       GLU  61  -3.901  -0.034  -8.260
  472    HB2  GLU  61           HB3      GLU  61  -4.239   2.188  -9.889
  473    HB3  GLU  61           HB2      GLU  61  -5.306   0.958 -10.557
  474    HG2  GLU  61           HG3      GLU  61  -5.602   0.931  -7.725
  475    HG3  GLU  61           HG2      GLU  61  -5.778   2.583  -8.344
  476    H    GLU  62           H        GLU  62  -3.646  -0.232 -11.786
  477    HA   GLU  62           HA       GLU  62  -5.249  -2.523 -12.049
  478    HB2  GLU  62           HB3      GLU  62  -4.764  -2.494 -14.281
  479    HB3  GLU  62           HB2      GLU  62  -4.411  -0.822 -13.846
  480    HG2  GLU  62           HG3      GLU  62  -2.028  -1.445 -13.599
  481    HG3  GLU  62           HG2      GLU  62  -2.415  -3.070 -14.235
  482    H    THR  63           H        THR  63  -1.758  -2.161 -11.823
  483    HA   THR  63           HA       THR  63  -1.101  -4.886 -12.182
  484    HB   THR  63           HB       THR  63   0.292  -2.442 -11.684
  485    HG1  THR  63           HG1      THR  63   1.601  -3.530 -12.900
  486   HG21  THR  63          HG21      THR  63   1.781  -2.820  -9.994
  487   HG22  THR  63          HG22      THR  63   1.478  -4.544  -9.900
  488   HG23  THR  63          HG23      THR  63   0.257  -3.414  -9.251
  489    H    LEU  64           H        LEU  64  -2.181  -3.080  -9.411
  490    HA   LEU  64           HA       LEU  64  -1.475  -5.011  -7.444
  491    HB2  LEU  64           HB3      LEU  64  -2.921  -2.447  -7.581
  492    HB3  LEU  64           HB2      LEU  64  -3.636  -3.613  -6.426
  493    HG   LEU  64           HG       LEU  64  -0.777  -2.580  -6.431
  494   HD11  LEU  64          HD11      LEU  64  -1.837  -0.873  -5.473
  495   HD12  LEU  64          HD12      LEU  64  -1.781  -1.891  -4.075
  496   HD13  LEU  64          HD13      LEU  64  -3.262  -1.837  -5.006
  497   HD21  LEU  64          HD21      LEU  64  -0.495  -3.881  -4.386
  498   HD22  LEU  64          HD22      LEU  64  -0.971  -4.963  -5.704
  499   HD23  LEU  64          HD23      LEU  64  -2.161  -4.435  -4.484
  500    H    MET  65           H        MET  65  -4.264  -4.466  -9.498
  501    HA   MET  65           HA       MET  65  -6.096  -6.162  -8.199
  502    HB2  MET  65           HB3      MET  65  -5.820  -5.309 -11.074
  503    HB3  MET  65           HB2      MET  65  -7.144  -6.367 -10.492
  504    HG2  MET  65           HG3      MET  65  -6.535  -3.518  -9.740
  505    HG3  MET  65           HG2      MET  65  -7.945  -4.117 -10.561
  506    HE1  MET  65           HE1      MET  65  -6.427  -3.080  -7.363
  507    HE2  MET  65           HE2      MET  65  -6.007  -4.733  -7.080
  508    HE3  MET  65           HE3      MET  65  -7.241  -3.985  -6.113
  509    H    GLU  66           H        GLU  66  -3.693  -6.815 -10.683
  510    HA   GLU  66           HA       GLU  66  -4.352  -9.597 -10.883
  511    HB2  GLU  66           HB3      GLU  66  -2.121  -9.632 -12.189
  512    HB3  GLU  66           HB2      GLU  66  -3.482  -8.767 -12.853
  513    HG2  GLU  66           HG3      GLU  66  -2.557  -6.631 -12.107
  514    HG3  GLU  66           HG2      GLU  66  -1.244  -7.499 -11.302
  515    H    TYR  67           H        TYR  67  -1.938  -7.607  -9.231
  516    HA   TYR  67           HA       TYR  67  -0.239  -9.655  -8.336
  517    HB2  TYR  67           HB3      TYR  67   0.758  -7.656  -8.020
  518    HB3  TYR  67           HB2      TYR  67  -0.723  -6.846  -7.645
  519    HD1  TYR  67           HD1      TYR  67   2.114  -8.608  -6.315
  520    HD2  TYR  67           HD2      TYR  67  -1.655  -6.965  -5.354
  521    HE1  TYR  67           HE1      TYR  67   2.702  -8.695  -3.929
  522    HE2  TYR  67           HE2      TYR  67  -1.041  -7.026  -2.950
  523    HH   TYR  67           HH       TYR  67   0.720  -7.200  -1.517
  524    H    LEU  68           H        LEU  68  -3.337  -8.664  -7.339
  525    HA   LEU  68           HA       LEU  68  -3.337  -9.554  -4.649
  526    HB2  LEU  68           HB3      LEU  68  -5.514  -9.181  -6.679
  527    HB3  LEU  68           HB2      LEU  68  -5.869  -9.849  -5.130
  528    HG   LEU  68           HG       LEU  68  -4.577  -7.167  -5.518
  529   HD11  LEU  68          HD11      LEU  68  -6.666  -6.173  -5.110
  530   HD12  LEU  68          HD12      LEU  68  -7.437  -7.720  -4.805
  531   HD13  LEU  68          HD13      LEU  68  -6.909  -7.339  -6.414
  532   HD21  LEU  68          HD21      LEU  68  -4.051  -8.130  -3.368
  533   HD22  LEU  68          HD22      LEU  68  -5.761  -8.490  -3.116
  534   HD23  LEU  68          HD23      LEU  68  -5.191  -6.795  -3.172
  535    H    GLU  69           H        GLU  69  -3.211 -11.254  -7.578
  536    HA   GLU  69           HA       GLU  69  -4.560 -13.631  -6.873
  537    HB2  GLU  69           HB3      GLU  69  -3.184 -12.741  -9.081
  538    HB3  GLU  69           HB2      GLU  69  -2.146 -14.037  -8.498
  539    HG2  GLU  69           HG3      GLU  69  -4.000 -15.557  -8.616
  540    HG3  GLU  69           HG2      GLU  69  -5.042 -14.294  -9.168
  541    H    ASN  70           H        ASN  70  -1.057 -13.563  -7.214
  542    HA   ASN  70           HA       ASN  70  -0.857 -15.125  -4.742
  543    HB2  ASN  70           HB3      ASN  70   0.547 -15.401  -7.331
  544    HB3  ASN  70           HB2      ASN  70   1.369 -15.920  -5.897
  545   HD21  ASN  70          HD21      ASN  70  -0.972 -16.664  -8.221
  546   HD22  ASN  70          HD22      ASN  70  -1.513 -18.183  -7.547
  547    HA   PRO  71           HA       PRO  71   1.169 -11.153  -3.684
  548    HB2  PRO  71           HB3      PRO  71   1.144 -12.651  -1.105
  549    HB3  PRO  71           HB2      PRO  71   0.763 -10.943  -1.417
  550    HG2  PRO  71           HG3      PRO  71  -1.149 -12.776  -1.002
  551    HG3  PRO  71           HG2      PRO  71  -1.372 -11.488  -2.248
  552    HD2  PRO  71           HD3      PRO  71  -0.740 -14.387  -2.615
  553    HD3  PRO  71           HD2      PRO  71  -1.708 -13.274  -3.615
  554    H    LYS  72           H        LYS  72   2.113 -14.481  -2.944
  555    HA   LYS  72           HA       LYS  72   4.839 -13.773  -2.291
  556    HB2  LYS  72           HB3      LYS  72   4.820 -15.801  -1.362
  557    HB3  LYS  72           HB2      LYS  72   3.164 -16.039  -1.941
  558    HG2  LYS  72           HG3      LYS  72   4.160 -17.839  -2.869
  559    HG3  LYS  72           HG2      LYS  72   4.368 -16.674  -4.149
  560    HD2  LYS  72           HD3      LYS  72   6.525 -16.458  -2.389
  561    HD3  LYS  72           HD2      LYS  72   6.355 -18.151  -2.781
  562    HE2  LYS  72           HE3      LYS  72   6.000 -16.698  -5.170
  563    HE3  LYS  72           HE2      LYS  72   7.436 -16.010  -4.373
  564    HZ1  LYS  72           HZ1      LYS  72   8.400 -18.211  -4.241
  565    HZ2  LYS  72           HZ2      LYS  72   8.034 -17.851  -5.824
  566    HZ3  LYS  72           HZ3      LYS  72   7.036 -18.903  -4.956
  567    H    LYS  73           H        LYS  73   3.041 -14.584  -5.142
  568    HA   LYS  73           HA       LYS  73   5.170 -15.514  -6.740
  569    HB2  LYS  73           HB3      LYS  73   3.670 -15.586  -8.487
  570    HB3  LYS  73           HB2      LYS  73   2.613 -15.700  -7.101
  571    HG2  LYS  73           HG3      LYS  73   1.506 -14.057  -8.187
  572    HG3  LYS  73           HG2      LYS  73   2.677 -13.047  -7.384
  573    HD2  LYS  73           HD3      LYS  73   2.312 -12.736  -9.930
  574    HD3  LYS  73           HD2      LYS  73   3.952 -12.806  -9.336
  575    HE2  LYS  73           HE3      LYS  73   3.428 -14.171 -11.402
  576    HE3  LYS  73           HE2      LYS  73   4.171 -15.044 -10.069
  577    HZ1  LYS  73           HZ1      LYS  73   1.857 -15.679  -9.413
  578    HZ2  LYS  73           HZ2      LYS  73   2.451 -16.422 -10.837
  579    HZ3  LYS  73           HZ3      LYS  73   1.369 -15.104 -10.929
  580    H    TYR  74           H        TYR  74   3.952 -12.362  -5.935
  581    HA   TYR  74           HA       TYR  74   5.435 -11.005  -7.990
  582    HB2  TYR  74           HB3      TYR  74   3.493 -10.246  -5.865
  583    HB3  TYR  74           HB2      TYR  74   4.725  -9.019  -6.312
  584    HD1  TYR  74           HD1      TYR  74   2.178 -11.303  -7.829
  585    HD2  TYR  74           HD2      TYR  74   4.380  -7.660  -8.146
  586    HE1  TYR  74           HE1      TYR  74   0.853 -10.645  -9.813
  587    HE2  TYR  74           HE2      TYR  74   3.051  -7.034 -10.109
  588    HH   TYR  74           HH       TYR  74   0.741  -9.251 -11.609
  589    H    ILE  75           H        ILE  75   5.644 -11.430  -4.446
  590    HA   ILE  75           HA       ILE  75   8.456 -10.616  -4.628
  591    HB   ILE  75           HB       ILE  75   6.500  -9.677  -2.644
  592   HG12  ILE  75          HG13      ILE  75   6.581  -8.124  -4.355
  593   HG13  ILE  75          HG12      ILE  75   7.730  -7.465  -3.221
  594   HG21  ILE  75          HG21      ILE  75   8.522  -8.628  -1.474
  595   HG22  ILE  75          HG22      ILE  75   9.493  -9.787  -2.421
  596   HG23  ILE  75          HG23      ILE  75   8.269 -10.385  -1.274
  597   HD11  ILE  75          HD11      ILE  75   9.079  -7.353  -5.017
  598   HD12  ILE  75          HD12      ILE  75   8.120  -8.559  -5.933
  599   HD13  ILE  75          HD13      ILE  75   9.319  -9.092  -4.719
  600    HA   PRO  76           HA       PRO  76   7.957 -14.845  -2.757
  601    HB2  PRO  76           HB3      PRO  76  10.698 -15.037  -3.940
  602    HB3  PRO  76           HB2      PRO  76   9.334 -16.195  -4.025
  603    HG2  PRO  76           HG3      PRO  76  10.007 -14.734  -6.093
  604    HG3  PRO  76           HG2      PRO  76   8.309 -15.055  -5.742
  605    HD2  PRO  76           HD3      PRO  76   9.904 -12.554  -5.238
  606    HD3  PRO  76           HD2      PRO  76   8.209 -12.758  -5.770
  607    H    GLY  77           H        GLY  77   8.625 -15.300  -0.735
  608    HA2  GLY  77           HA3      GLY  77  10.369 -15.530   0.954
  609    HA3  GLY  77           HA2      GLY  77  11.116 -14.117   0.233
  610    H    THR  78           H        THR  78   8.281 -12.953   0.145
  611    HA   THR  78           HA       THR  78   8.344 -11.908   2.884
  612    HB   THR  78           HB       THR  78   8.207 -10.592   0.446
  613    HG1  THR  78           HG1      THR  78   7.228  -9.608   2.922
  614   HG21  THR  78          HG21      THR  78   5.767 -11.369   0.389
  615   HG22  THR  78          HG22      THR  78   6.109  -9.675   0.140
  616   HG23  THR  78          HG23      THR  78   5.521 -10.173   1.698
  617    H    LYS  79           H        LYS  79   6.856 -12.363   4.336
  618    HA   LYS  79           HA       LYS  79   4.442 -13.770   3.353
  619    HB2  LYS  79           HB3      LYS  79   6.122 -14.806   5.034
  620    HB3  LYS  79           HB2      LYS  79   5.350 -13.778   6.210
  621    HG2  LYS  79           HG3      LYS  79   4.552 -16.236   5.916
  622    HG3  LYS  79           HG2      LYS  79   3.375 -14.881   6.107
  623    HD2  LYS  79           HD3      LYS  79   2.800 -16.514   4.291
  624    HD3  LYS  79           HD2      LYS  79   2.977 -14.872   3.738
  625    HE2  LYS  79           HE3      LYS  79   4.023 -16.484   2.204
  626    HE3  LYS  79           HE2      LYS  79   5.184 -15.248   2.861
  627    HZ1  LYS  79           HZ1      LYS  79   6.048 -17.551   2.921
  628    HZ2  LYS  79           HZ2      LYS  79   4.880 -17.981   4.038
  629    HZ3  LYS  79           HZ3      LYS  79   6.038 -16.849   4.433
  630    H    MET  80           H        MET  80   2.404 -13.067   4.073
  631    HA   MET  80           HA       MET  80   2.451 -10.391   5.360
  632    HB2  MET  80           HB3      MET  80   1.331 -10.787   3.063
  633    HB3  MET  80           HB2      MET  80   0.058 -11.662   3.974
  634    HG2  MET  80           HG3      MET  80  -0.846  -9.580   3.872
  635    HG3  MET  80           HG2      MET  80   0.038  -9.472   5.416
  636    HE1  MET  80           HE1      MET  80   2.109  -9.568   2.124
  637    HE2  MET  80           HE2      MET  80   1.909  -7.883   1.495
  638    HE3  MET  80           HE3      MET  80   0.546  -8.979   1.531
  639    H    ILE  81           H        ILE  81   2.132 -10.514   7.092
  640    HA   ILE  81           HA       ILE  81   0.342 -12.544   8.604
  641    HB   ILE  81           HB       ILE  81   2.299 -10.661   9.932
  642   HG12  ILE  81          HG13      ILE  81   3.231 -13.129  10.452
  643   HG13  ILE  81          HG12      ILE  81   2.274 -13.494   8.998
  644   HG21  ILE  81          HG21      ILE  81   1.304 -12.924  11.521
  645   HG22  ILE  81          HG22      ILE  81   0.175 -11.576  11.284
  646   HG23  ILE  81          HG23      ILE  81   1.765 -11.294  12.010
  647   HD11  ILE  81          HD11      ILE  81   4.360 -13.023   8.115
  648   HD12  ILE  81          HD12      ILE  81   4.718 -11.830   9.323
  649   HD13  ILE  81          HD13      ILE  81   3.617 -11.433   8.007
  650    H    PHE  82           H        PHE  82  -1.632 -11.927   9.752
  651    HA   PHE  82           HA       PHE  82  -3.142 -10.637  10.865
  652    HB2  PHE  82           HB3      PHE  82  -1.067  -9.122  11.392
  653    HB3  PHE  82           HB2      PHE  82  -1.674  -8.126  10.133
  654    HD1  PHE  82           HD1      PHE  82  -2.305  -9.474  13.483
  655    HD2  PHE  82           HD2      PHE  82  -3.706  -6.828  10.421
  656    HE1  PHE  82           HE1      PHE  82  -3.803  -8.403  15.088
  657    HE2  PHE  82           HE2      PHE  82  -5.218  -5.803  12.060
  658    HZ   PHE  82           HZ       PHE  82  -5.320  -6.621  14.376
  659    H    ALA  83           H        ALA  83  -4.798  -8.972  10.222
  660    HA   ALA  83           HA       ALA  83  -5.344  -7.533   8.141
  661    HB1  ALA  83           HB1      ALA  83  -6.083  -9.326   6.340
  662    HB2  ALA  83           HB2      ALA  83  -4.813 -10.251   7.091
  663    HB3  ALA  83           HB3      ALA  83  -4.457  -8.650   6.411
  664    H    GLY  84           H        GLY  84  -7.023  -7.081   9.626
  665    HA2  GLY  84           HA3      GLY  84  -9.053  -9.089  10.149
  666    HA3  GLY  84           HA2      GLY  84  -9.079  -7.392  10.623
  667    H    ILE  85           H        ILE  85  -8.457  -7.861   7.344
  668    HA   ILE  85           HA       ILE  85 -11.313  -7.500   6.650
  669    HB   ILE  85           HB       ILE  85  -8.986  -5.881   5.507
  670   HG12  ILE  85          HG13      ILE  85 -10.534  -5.441   7.842
  671   HG13  ILE  85          HG12      ILE  85  -9.555  -4.228   6.973
  672   HG21  ILE  85          HG21      ILE  85 -11.940  -5.812   4.785
  673   HG22  ILE  85          HG22      ILE  85 -10.642  -6.449   3.823
  674   HG23  ILE  85          HG23      ILE  85 -10.696  -4.751   4.179
  675   HD11  ILE  85          HD11      ILE  85 -11.693  -3.944   5.508
  676   HD12  ILE  85          HD12      ILE  85 -11.591  -3.201   7.105
  677   HD13  ILE  85          HD13      ILE  85 -12.471  -4.687   6.924
  678    H    LYS  86           H        LYS  86 -11.943  -8.281   4.663
  679    HA   LYS  86           HA       LYS  86  -9.942  -9.548   2.946
  680    HB2  LYS  86           HB3      LYS  86 -11.564 -11.621   3.036
  681    HB3  LYS  86           HB2      LYS  86 -10.240 -11.476   4.136
  682    HG2  LYS  86           HG3      LYS  86 -12.495 -10.159   5.239
  683    HG3  LYS  86           HG2      LYS  86 -12.960 -11.813   4.717
  684    HD2  LYS  86           HD3      LYS  86 -11.487 -12.864   6.117
  685    HD3  LYS  86           HD2      LYS  86 -10.411 -11.471   6.214
  686    HE2  LYS  86           HE3      LYS  86 -12.536 -10.361   7.377
  687    HE3  LYS  86           HE2      LYS  86 -12.969 -12.010   7.722
  688    HZ1  LYS  86           HZ1      LYS  86 -10.258 -10.998   8.358
  689    HZ2  LYS  86           HZ2      LYS  86 -11.055 -12.330   9.021
  690    HZ3  LYS  86           HZ3      LYS  86 -11.590 -10.785   9.419
  691    H    LYS  87           H        LYS  87 -13.352  -8.846   3.601
  692    HA   LYS  87           HA       LYS  87 -14.702  -9.438   1.391
  693    HB2  LYS  87           HB3      LYS  87 -15.001  -7.567   3.466
  694    HB3  LYS  87           HB2      LYS  87 -15.200  -6.671   1.934
  695    HG2  LYS  87           HG3      LYS  87 -17.292  -7.384   1.836
  696    HG3  LYS  87           HG2      LYS  87 -16.680  -9.008   1.612
  697    HD2  LYS  87           HD3      LYS  87 -16.505  -9.166   4.162
  698    HD3  LYS  87           HD2      LYS  87 -17.460  -7.684   4.203
  699    HE2  LYS  87           HE3      LYS  87 -18.789  -9.786   4.460
  700    HE3  LYS  87           HE2      LYS  87 -19.296  -8.724   3.140
  701    HZ1  LYS  87           HZ1      LYS  87 -19.023 -11.254   2.767
  702    HZ2  LYS  87           HZ2      LYS  87 -17.348 -10.914   2.600
  703    HZ3  LYS  87           HZ3      LYS  87 -18.482 -10.179   1.580
  704    H    LYS  88           H        LYS  88 -14.245  -9.325  -0.723
  705    HA   LYS  88           HA       LYS  88 -12.187  -7.861  -1.866
  706    HB2  LYS  88           HB3      LYS  88 -13.370  -9.696  -3.003
  707    HB3  LYS  88           HB2      LYS  88 -14.831  -8.731  -3.130
  708    HG2  LYS  88           HG3      LYS  88 -13.840  -7.218  -4.632
  709    HG3  LYS  88           HG2      LYS  88 -12.212  -7.944  -4.391
  710    HD2  LYS  88           HD3      LYS  88 -14.472  -8.889  -6.045
  711    HD3  LYS  88           HD2      LYS  88 -12.724  -9.051  -6.264
  712    HE2  LYS  88           HE3      LYS  88 -13.687 -11.196  -5.917
  713    HE3  LYS  88           HE2      LYS  88 -12.780 -10.784  -4.466
  714    HZ1  LYS  88           HZ1      LYS  88 -15.424 -11.566  -4.583
  715    HZ2  LYS  88           HZ2      LYS  88 -15.460  -9.896  -4.274
  716    HZ3  LYS  88           HZ3      LYS  88 -14.594 -10.929  -3.225
  717    H    THR  89           H        THR  89 -15.475  -6.860  -1.289
  718    HA   THR  89           HA       THR  89 -15.316  -4.445  -2.723
  719    HB   THR  89           HB       THR  89 -17.481  -4.022  -1.958
  720    HG1  THR  89           HG1      THR  89 -17.353  -3.777   0.177
  721   HG21  THR  89          HG21      THR  89 -17.363  -6.928  -1.314
  722   HG22  THR  89          HG22      THR  89 -17.426  -6.302  -2.966
  723   HG23  THR  89          HG23      THR  89 -18.758  -5.986  -1.839
  724    H    GLU  90           H        GLU  90 -14.484  -5.391   0.490
  725    HA   GLU  90           HA       GLU  90 -14.204  -2.730   1.502
  726    HB2  GLU  90           HB3      GLU  90 -12.966  -5.294   2.575
  727    HB3  GLU  90           HB2      GLU  90 -13.155  -3.787   3.461
  728    HG2  GLU  90           HG3      GLU  90 -15.655  -4.925   2.342
  729    HG3  GLU  90           HG2      GLU  90 -14.847  -5.867   3.639
  730    H    ARG  91           H        ARG  91 -11.946  -5.200   0.366
  731    HA   ARG  91           HA       ARG  91  -9.610  -3.720   0.722
  732    HB2  ARG  91           HB3      ARG  91 -10.108  -5.929  -1.221
  733    HB3  ARG  91           HB2      ARG  91  -8.589  -5.083  -1.103
  734    HG2  ARG  91           HG3      ARG  91  -9.019  -5.746   1.478
  735    HG3  ARG  91           HG2      ARG  91  -9.842  -7.076   0.683
  736    HD2  ARG  91           HD3      ARG  91  -7.205  -6.918  -0.601
  737    HD3  ARG  91           HD2      ARG  91  -7.097  -6.639   1.135
  738    HE   ARG  91           HE       ARG  91  -8.437  -8.773   1.139
  739   HH11  ARG  91          HH11      ARG  91  -6.030  -7.796  -1.203
  740   HH12  ARG  91          HH12      ARG  91  -5.512  -9.411  -1.546
  741   HH21  ARG  91          HH21      ARG  91  -7.762 -10.897   0.681
  742   HH22  ARG  91          HH22      ARG  91  -6.466 -11.170  -0.428
  743    H    GLU  92           H        GLU  92 -11.631  -4.151  -2.196
  744    HA   GLU  92           HA       GLU  92 -10.158  -2.527  -3.886
  745    HB2  GLU  92           HB3      GLU  92 -11.995  -4.139  -4.482
  746    HB3  GLU  92           HB2      GLU  92 -13.148  -2.860  -3.961
  747    HG2  GLU  92           HG3      GLU  92 -12.895  -2.784  -6.356
  748    HG3  GLU  92           HG2      GLU  92 -12.178  -1.342  -5.638
  749    H    ASP  93           H        ASP  93 -12.729  -1.772  -1.595
  750    HA   ASP  93           HA       ASP  93 -13.175   0.893  -2.391
  751    HB2  ASP  93           HB3      ASP  93 -14.764  -0.069  -0.895
  752    HB3  ASP  93           HB2      ASP  93 -13.506  -0.526   0.248
  753    H    GLY  94           H        GLY  94 -10.951  -0.417   0.026
  754    HA2  GLY  94           HA3      GLY  94  -9.881   1.997   0.886
  755    HA3  GLY  94           HA2      GLY  94  -9.057   0.433   0.957
  756    H    ILE  95           H        ILE  95  -9.087   0.013  -1.842
  757    HA   ILE  95           HA       ILE  95  -6.654   1.239  -2.595
  758    HB   ILE  95           HB       ILE  95  -8.672  -0.423  -3.961
  759   HG12  ILE  95          HG13      ILE  95  -5.672  -0.413  -3.641
  760   HG13  ILE  95          HG12      ILE  95  -6.833  -1.461  -2.829
  761   HG21  ILE  95          HG21      ILE  95  -8.540   0.593  -5.935
  762   HG22  ILE  95          HG22      ILE  95  -6.853   0.096  -5.976
  763   HG23  ILE  95          HG23      ILE  95  -7.258   1.694  -5.349
  764   HD11  ILE  95          HD11      ILE  95  -6.526  -1.497  -5.818
  765   HD12  ILE  95          HD12      ILE  95  -7.213  -2.744  -4.743
  766   HD13  ILE  95          HD13      ILE  95  -5.494  -2.450  -4.721
  767    H    ALA  96           H        ALA  96 -10.049   2.034  -3.328
  768    HA   ALA  96           HA       ALA  96  -9.603   3.978  -5.269
  769    HB1  ALA  96           HB1      ALA  96 -11.822   3.182  -4.838
  770    HB2  ALA  96           HB2      ALA  96 -11.795   4.930  -4.600
  771    HB3  ALA  96           HB3      ALA  96 -11.784   3.835  -3.179
  772    H    TYR  97           H        TYR  97  -9.847   4.241  -1.739
  773    HA   TYR  97           HA       TYR  97  -9.407   7.036  -1.542
  774    HB2  TYR  97           HB3      TYR  97 -10.201   5.901   0.384
  775    HB3  TYR  97           HB2      TYR  97  -8.911   4.764   0.381
  776    HD1  TYR  97           HD1      TYR  97  -7.954   5.072   2.504
  777    HD2  TYR  97           HD2      TYR  97  -8.657   8.454   0.021
  778    HE1  TYR  97           HE1      TYR  97  -6.686   6.465   4.030
  779    HE2  TYR  97           HE2      TYR  97  -7.385   9.883   1.553
  780    HH   TYR  97           HH       TYR  97  -5.568   8.523   4.221
  781    H    LEU  98           H        LEU  98  -7.229   4.294  -1.726
  782    HA   LEU  98           HA       LEU  98  -4.784   5.633  -1.189
  783    HB2  LEU  98           HB3      LEU  98  -5.577   3.029  -1.801
  784    HB3  LEU  98           HB2      LEU  98  -4.549   3.511  -3.150
  785    HG   LEU  98           HG       LEU  98  -3.751   3.727  -0.251
  786   HD11  LEU  98          HD11      LEU  98  -2.271   1.650  -1.316
  787   HD12  LEU  98          HD12      LEU  98  -3.922   1.363  -1.987
  788   HD13  LEU  98          HD13      LEU  98  -3.645   1.489  -0.256
  789   HD21  LEU  98          HD21      LEU  98  -2.233   3.916  -2.859
  790   HD22  LEU  98          HD22      LEU  98  -1.463   3.711  -1.303
  791   HD23  LEU  98          HD23      LEU  98  -2.438   5.115  -1.596
  792    H    LYS  99           H        LYS  99  -6.657   5.224  -4.149
  793    HA   LYS  99           HA       LYS  99  -4.784   6.060  -6.016
  794    HB2  LYS  99           HB3      LYS  99  -7.704   6.678  -6.137
  795    HB3  LYS  99           HB2      LYS  99  -6.603   6.476  -7.497
  796    HG2  LYS  99           HG3      LYS  99  -7.526   4.324  -5.594
  797    HG3  LYS  99           HG2      LYS  99  -8.011   4.535  -7.276
  798    HD2  LYS  99           HD3      LYS  99  -6.320   2.864  -6.608
  799    HD3  LYS  99           HD2      LYS  99  -5.364   4.380  -7.633
  800    HE2  LYS  99           HE3      LYS  99  -4.198   3.647  -5.884
  801    HE3  LYS  99           HE2      LYS  99  -5.568   3.800  -4.864
  802    HZ1  LYS  99           HZ1      LYS  99  -4.300   1.496  -5.580
  803    HZ2  LYS  99           HZ2      LYS  99  -5.781   1.487  -6.333
  804    HZ3  LYS  99           HZ3      LYS  99  -5.696   1.678  -4.632
  805    H    LYS 100           H        LYS 100  -7.095   7.962  -4.061
  806    HA   LYS 100           HA       LYS 100  -6.243  10.474  -5.216
  807    HB2  LYS 100           HB3      LYS 100  -8.295  10.944  -4.433
  808    HB3  LYS 100           HB2      LYS 100  -8.284   9.547  -3.369
  809    HG2  LYS 100           HG3      LYS 100  -6.942  10.855  -1.747
  810    HG3  LYS 100           HG2      LYS 100  -7.125  12.236  -2.810
  811    HD2  LYS 100           HD3      LYS 100  -9.263  10.720  -1.361
  812    HD3  LYS 100           HD2      LYS 100  -8.794  12.387  -1.088
  813    HE2  LYS 100           HE3      LYS 100  -9.887  11.432  -3.694
  814    HE3  LYS 100           HE2      LYS 100 -10.903  11.994  -2.414
  815    HZ1  LYS 100           HZ1      LYS 100  -9.499  13.479  -4.318
  816    HZ2  LYS 100           HZ2      LYS 100  -8.845  13.891  -2.801
  817    HZ3  LYS 100           HZ3      LYS 100 -10.525  14.088  -3.119
  818    H    ALA 101           H        ALA 101  -5.589   8.604  -2.316
  819    HA   ALA 101           HA       ALA 101  -4.189  10.461  -0.800
  820    HB1  ALA 101           HB1      ALA 101  -3.436   7.555  -0.808
  821    HB2  ALA 101           HB2      ALA 101  -4.981   8.069  -0.233
  822    HB3  ALA 101           HB3      ALA 101  -3.518   8.633   0.545
  823    H    THR 102           H        THR 102  -3.235   8.670  -3.577
  824    HA   THR 102           HA       THR 102  -0.449   9.555  -3.240
  825    HB   THR 102           HB       THR 102  -0.398   7.283  -3.831
  826    HG1  THR 102           HG1      THR 102  -0.893   7.947  -5.487
  827   HG21  THR 102          HG21      THR 102  -2.897   7.852  -5.207
  828   HG22  THR 102          HG22      THR 102  -2.319   6.332  -4.486
  829   HG23  THR 102          HG23      THR 102  -1.822   6.774  -6.083
  830    H    ASN 103           H        ASN 103  -3.390  10.035  -4.847
  831    HA   ASN 103           HA       ASN 103  -2.363  12.431  -6.040
  832    HB2  ASN 103           HB3      ASN 103  -3.791  10.717  -8.070
  833    HB3  ASN 103           HB2      ASN 103  -2.514  11.946  -8.274
  834   HD21  ASN 103          HD21      ASN 103  -3.143   8.663  -7.296
  835   HD22  ASN 103          HD22      ASN 103  -1.522   8.069  -7.610
  836    H    GLU 104           H        GLU 104  -3.854  13.782  -5.306
  837    HA   GLU 104           HA       GLU 104  -6.285  14.320  -6.164
  838    HB2  GLU 104           HB3      GLU 104  -6.450  11.965  -4.385
  839    HB3  GLU 104           HB2      GLU 104  -7.733  13.138  -4.300
  840    HG2  GLU 104           HG3      GLU 104  -7.092  12.370  -7.033
  841    HG3  GLU 104           HG2      GLU 104  -7.612  11.031  -5.997
  842    HHA  HEC 201           HHA      HEC 201   5.234  -5.196   0.477
  843    HHB  HEC 201           HHB      HEC 201  -0.275  -2.494   0.349
  844    HHC  HEC 201           HHC      HEC 201  -1.956  -6.222   5.159
  845    HHD  HEC 201           HHD      HEC 201   4.145  -6.004   6.774
  846   HMA1  HEC 201          HMA1      HEC 201   1.053  -1.190  -1.163
  847   HMA2  HEC 201          HMA2      HEC 201   2.634  -0.370  -0.628
  848   HMA3  HEC 201          HMA3      HEC 201   2.437  -1.609  -1.499
  849   HAA1  HEC 201          HAA1      HEC 201   5.121  -3.086  -1.360
  850   HAA2  HEC 201          HAA2      HEC 201   5.682  -2.455   0.220
  851   HBA1  HEC 201          HBA1      HEC 201   4.224  -0.434  -0.213
  852   HBA2  HEC 201          HBA2      HEC 201   3.994  -1.011  -1.849
  853   HMB1  HEC 201          HMB1      HEC 201  -3.460  -1.967   2.051
  854   HMB2  HEC 201          HMB2      HEC 201  -3.539  -3.233   0.769
  855   HMB3  HEC 201          HMB3      HEC 201  -2.262  -1.990   0.688
  856    HAB  HEC 201           HAB      HEC 201  -3.812  -3.353   4.520
  857   HBB1  HEC 201          HBB1      HEC 201  -5.255  -5.271   2.683
  858   HBB2  HEC 201          HBB2      HEC 201  -4.607  -3.777   1.973
  859   HBB3  HEC 201          HBB3      HEC 201  -5.721  -3.691   3.366
  860   HMC1  HEC 201          HMC1      HEC 201  -0.871  -7.721   8.489
  861   HMC2  HEC 201          HMC2      HEC 201  -1.851  -7.809   6.861
  862   HMC3  HEC 201          HMC3      HEC 201  -0.519  -8.487   7.210
  863    HAC  HEC 201           HAC      HEC 201   3.052  -7.057   8.236
  864   HBC1  HEC 201          HBC1      HEC 201   3.325  -9.445   7.679
  865   HBC2  HEC 201          HBC2      HEC 201   1.673  -9.754   8.251
  866   HBC3  HEC 201          HBC3      HEC 201   2.926  -9.204   9.398
  867   HMD1  HEC 201          HMD1      HEC 201   6.062  -7.212   6.357
  868   HMD2  HEC 201          HMD2      HEC 201   7.191  -5.913   5.983
  869   HMD3  HEC 201          HMD3      HEC 201   7.268  -7.506   5.121
  870   HAD1  HEC 201          HAD1      HEC 201   8.021  -6.483   3.138
  871   HAD2  HEC 201          HAD2      HEC 201   7.629  -5.051   2.216
  872   HBD1  HEC 201          HBD1      HEC 201   7.922  -7.703   1.286
  873   HBD2  HEC 201          HBD2      HEC 201   7.407  -6.239   0.351
  Start of MODEL   15
    1    H1   GLY   1          1H        GLY   1 -19.206   4.164  -0.475
    2    H2   GLY   1          2H        GLY   1 -18.585   3.657  -1.964
    3    H3   GLY   1          3H        GLY   1 -18.749   5.308  -1.636
    4    HA2  GLY   1           HA2      GLY   1 -17.144   3.898   0.296
    5    HA3  GLY   1           HA3      GLY   1 -16.476   3.881  -1.329
    6    H    ASP   2           H        ASP   2 -16.366   5.389   1.561
    7    HA   ASP   2           HA       ASP   2 -15.751   7.942   0.251
    8    HB2  ASP   2           HB3      ASP   2 -16.406   7.569   3.181
    9    HB3  ASP   2           HB2      ASP   2 -16.391   9.094   2.227
   10    H    VAL   3           H        VAL   3 -13.993   9.192   1.196
   11    HA   VAL   3           HA       VAL   3 -11.667   7.668   1.421
   12    HB   VAL   3           HB       VAL   3 -12.300  10.523   1.640
   13   HG11  VAL   3          HG11      VAL   3 -10.984  10.579   3.510
   14   HG12  VAL   3          HG12      VAL   3  -9.810  10.942   2.282
   15   HG13  VAL   3          HG13      VAL   3  -9.926   9.303   3.023
   16   HG21  VAL   3          HG21      VAL   3 -11.576  10.284  -0.440
   17   HG22  VAL   3          HG22      VAL   3 -10.897   8.705  -0.049
   18   HG23  VAL   3          HG23      VAL   3  -9.966  10.220   0.335
   19    H    GLU   4           H        GLU   4 -13.766   9.422   3.832
   20    HA   GLU   4           HA       GLU   4 -12.083   9.044   6.122
   21    HB2  GLU   4           HB3      GLU   4 -14.042  10.544   6.199
   22    HB3  GLU   4           HB2      GLU   4 -15.066   9.158   5.906
   23    HG2  GLU   4           HG3      GLU   4 -14.277   8.242   8.079
   24    HG3  GLU   4           HG2      GLU   4 -13.582   9.828   8.347
   25    H    LYS   5           H        LYS   5 -14.641   6.953   4.854
   26    HA   LYS   5           HA       LYS   5 -14.501   4.973   6.871
   27    HB2  LYS   5           HB3      LYS   5 -15.364   4.636   3.977
   28    HB3  LYS   5           HB2      LYS   5 -15.765   3.629   5.350
   29    HG2  LYS   5           HG3      LYS   5 -16.592   6.046   6.129
   30    HG3  LYS   5           HG2      LYS   5 -16.968   6.008   4.412
   31    HD2  LYS   5           HD3      LYS   5 -17.681   3.520   5.760
   32    HD3  LYS   5           HD2      LYS   5 -18.576   4.927   6.253
   33    HE2  LYS   5           HE3      LYS   5 -19.862   4.793   4.475
   34    HE3  LYS   5           HE2      LYS   5 -18.401   5.086   3.446
   35    HZ1  LYS   5           HZ1      LYS   5 -19.985   2.653   3.785
   36    HZ2  LYS   5           HZ2      LYS   5 -18.435   2.376   4.254
   37    HZ3  LYS   5           HZ3      LYS   5 -18.682   2.984   2.754
   38    H    GLY   6           H        GLY   6 -12.816   5.420   3.741
   39    HA2  GLY   6           HA3      GLY   6 -11.517   2.868   3.700
   40    HA3  GLY   6           HA2      GLY   6 -10.940   4.314   2.940
   41    H    LYS   7           H        LYS   7 -10.471   5.912   5.096
   42    HA   LYS   7           HA       LYS   7  -7.889   5.218   5.734
   43    HB2  LYS   7           HB3      LYS   7  -8.302   7.460   5.971
   44    HB3  LYS   7           HB2      LYS   7  -9.832   7.192   6.834
   45    HG2  LYS   7           HG3      LYS   7  -7.675   6.117   8.427
   46    HG3  LYS   7           HG2      LYS   7  -7.330   7.731   7.986
   47    HD2  LYS   7           HD3      LYS   7 -10.025   7.879   8.648
   48    HD3  LYS   7           HD2      LYS   7  -9.281   6.683   9.864
   49    HE2  LYS   7           HE3      LYS   7  -8.788   8.653  10.929
   50    HE3  LYS   7           HE2      LYS   7  -7.383   8.778   9.753
   51    HZ1  LYS   7           HZ1      LYS   7  -8.352  10.771   9.470
   52    HZ2  LYS   7           HZ2      LYS   7  -9.859  10.270   9.968
   53    HZ3  LYS   7           HZ3      LYS   7  -9.363   9.950   8.404
   54    H    LYS   8           H        LYS   8 -10.925   4.852   7.629
   55    HA   LYS   8           HA       LYS   8  -9.812   3.835  10.013
   56    HB2  LYS   8           HB3      LYS   8 -11.914   4.628  10.384
   57    HB3  LYS   8           HB2      LYS   8 -12.540   3.965   8.881
   58    HG2  LYS   8           HG3      LYS   8 -11.626   2.119  11.057
   59    HG3  LYS   8           HG2      LYS   8 -13.209   2.935  11.178
   60    HD2  LYS   8           HD3      LYS   8 -12.397   1.203   8.818
   61    HD3  LYS   8           HD2      LYS   8 -13.417   0.744  10.140
   62    HE2  LYS   8           HE3      LYS   8 -13.911   3.058   8.264
   63    HE3  LYS   8           HE2      LYS   8 -14.644   1.458   8.103
   64    HZ1  LYS   8           HZ1      LYS   8 -15.179   3.500  10.082
   65    HZ2  LYS   8           HZ2      LYS   8 -15.454   1.958  10.508
   66    HZ3  LYS   8           HZ3      LYS   8 -16.311   2.603   9.214
   67    H    ILE   9           H        ILE   9 -11.115   2.314   7.115
   68    HA   ILE   9           HA       ILE   9 -11.047  -0.348   8.005
   69    HB   ILE   9           HB       ILE   9 -11.168   0.982   5.358
   70   HG12  ILE   9          HG13      ILE   9 -12.681  -1.323   6.609
   71   HG13  ILE   9          HG12      ILE   9 -13.188   0.363   6.632
   72   HG21  ILE   9          HG21      ILE   9  -9.725  -0.484   4.449
   73   HG22  ILE   9          HG22      ILE   9 -11.092  -1.593   4.541
   74   HG23  ILE   9          HG23      ILE   9  -9.856  -1.612   5.798
   75   HD11  ILE   9          HD11      ILE   9 -13.544  -1.645   4.596
   76   HD12  ILE   9          HD12      ILE   9 -12.775  -0.196   3.951
   77   HD13  ILE   9          HD13      ILE   9 -14.324  -0.074   4.784
   78    H    PHE  10           H        PHE  10  -8.675   1.580   6.286
   79    HA   PHE  10           HA       PHE  10  -6.679  -0.463   5.991
   80    HB2  PHE  10           HB3      PHE  10  -6.274   1.295   4.565
   81    HB3  PHE  10           HB2      PHE  10  -6.630   2.558   5.781
   82    HD1  PHE  10           HD1      PHE  10  -4.101   0.760   4.075
   83    HD2  PHE  10           HD2      PHE  10  -5.031   2.840   7.635
   84    HE1  PHE  10           HE1      PHE  10  -1.663   1.075   4.526
   85    HE2  PHE  10           HE2      PHE  10  -2.579   3.137   8.106
   86    HZ   PHE  10           HZ       PHE  10  -0.980   2.267   6.499
   87    H    VAL  11           H        VAL  11  -7.396   2.021   8.381
   88    HA   VAL  11           HA       VAL  11  -4.880   1.973   9.530
   89    HB   VAL  11           HB       VAL  11  -7.655   2.504  10.809
   90   HG11  VAL  11          HG11      VAL  11  -6.593   3.318  12.665
   91   HG12  VAL  11          HG12      VAL  11  -4.966   3.413  11.951
   92   HG13  VAL  11          HG13      VAL  11  -5.699   1.863  12.386
   93   HG21  VAL  11          HG21      VAL  11  -7.495   4.411   9.671
   94   HG22  VAL  11          HG22      VAL  11  -5.958   4.022   8.975
   95   HG23  VAL  11          HG23      VAL  11  -6.043   4.822  10.549
   96    H    GLN  12           H        GLN  12  -7.749  -0.039  10.545
   97    HA   GLN  12           HA       GLN  12  -6.045  -1.474  12.492
   98    HB2  GLN  12           HB3      GLN  12  -8.185  -2.843  12.837
   99    HB3  GLN  12           HB2      GLN  12  -8.314  -1.102  13.257
  100    HG2  GLN  12           HG3      GLN  12 -10.151  -0.976  11.984
  101    HG3  GLN  12           HG2      GLN  12  -9.056  -1.173  10.553
  102   HE21  GLN  12          HE21      GLN  12  -8.262  -3.897  11.248
  103   HE22  GLN  12          HE22      GLN  12  -9.697  -4.866  10.807
  104    H    LYS  13           H        LYS  13  -7.814  -1.941   9.670
  105    HA   LYS  13           HA       LYS  13  -7.633  -4.230   8.495
  106    HB2  LYS  13           HB3      LYS  13  -7.960  -2.461   7.103
  107    HB3  LYS  13           HB2      LYS  13  -6.700  -1.586   7.525
  108    HG2  LYS  13           HG3      LYS  13  -6.177  -2.257   5.381
  109    HG3  LYS  13           HG2      LYS  13  -5.378  -3.412   6.455
  110    HD2  LYS  13           HD3      LYS  13  -6.503  -5.090   5.519
  111    HD3  LYS  13           HD2      LYS  13  -8.047  -4.286   5.908
  112    HE2  LYS  13           HE3      LYS  13  -7.157  -2.883   3.927
  113    HE3  LYS  13           HE2      LYS  13  -6.792  -4.661   3.409
  114    HZ1  LYS  13           HZ1      LYS  13  -9.374  -3.929   4.339
  115    HZ2  LYS  13           HZ2      LYS  13  -8.817  -5.324   3.448
  116    HZ3  LYS  13           HZ3      LYS  13  -8.926  -3.830   2.660
  117    H    CYS  14           H        CYS  14  -4.587  -2.227   8.883
  118    HA   CYS  14           HA       CYS  14  -2.984  -4.372   9.574
  119    HB2  CYS  14           HB3      CYS  14  -1.603  -4.800   7.671
  120    HB3  CYS  14           HB2      CYS  14  -3.274  -5.465   7.518
  121    H    ALA  15           H        ALA  15  -3.585  -1.287   9.491
  122    HA   ALA  15           HA       ALA  15  -1.369   0.100   8.590
  123    HB1  ALA  15           HB1      ALA  15  -2.774   0.834  11.138
  124    HB2  ALA  15           HB2      ALA  15  -3.552   0.998   9.564
  125    HB3  ALA  15           HB3      ALA  15  -2.076   1.895   9.914
  126    H    GLN  16           H        GLN  16  -1.518  -2.098  11.548
  127    HA   GLN  16           HA       GLN  16   0.703  -1.133  12.897
  128    HB2  GLN  16           HB3      GLN  16   0.423  -4.089  12.929
  129    HB3  GLN  16           HB2      GLN  16   0.492  -2.934  14.289
  130    HG2  GLN  16           HG3      GLN  16  -1.927  -2.261  13.597
  131    HG3  GLN  16           HG2      GLN  16  -1.928  -3.704  12.583
  132   HE21  GLN  16          HE21      GLN  16  -0.777  -2.948  15.835
  133   HE22  GLN  16          HE22      GLN  16  -1.585  -4.269  16.633
  134    H    CYS  17           H        CYS  17   0.533  -3.321  10.204
  135    HA   CYS  17           HA       CYS  17   3.325  -4.000  10.187
  136    HB2  CYS  17           HB3      CYS  17   1.506  -4.281   7.828
  137    HB3  CYS  17           HB2      CYS  17   2.849  -5.327   8.282
  138    H    HIS  18           H        HIS  18   1.340  -1.415   8.945
  139    HA   HIS  18           HA       HIS  18   3.623  -0.487   7.234
  140    HB2  HIS  18           HB3      HIS  18   0.662   0.312   7.152
  141    HB3  HIS  18           HB2      HIS  18   1.963   0.805   6.078
  142    HD1  HIS  18           HD1      HIS  18   1.757  -0.287   3.856
  143    HD2  HIS  18           HD2      HIS  18   0.727  -2.730   7.082
  144    HE1  HIS  18           HE1      HIS  18   1.115  -2.516   2.805
  145    H    THR  19           H        THR  19   3.123  -0.240  10.253
  146    HA   THR  19           HA       THR  19   3.234   1.319  11.871
  147    HB   THR  19           HB       THR  19   4.740   2.956   9.722
  148    HG1  THR  19           HG1      THR  19   6.573   1.717  10.511
  149   HG21  THR  19          HG21      THR  19   5.180   3.003  12.682
  150   HG22  THR  19          HG22      THR  19   4.256   4.125  11.786
  151   HG23  THR  19          HG23      THR  19   5.933   3.939  11.427
  152    H    VAL  20           H        VAL  20   2.647   3.529  12.619
  153    HA   VAL  20           HA       VAL  20   0.267   4.404  11.314
  154    HB   VAL  20           HB       VAL  20   1.306   5.743  13.711
  155   HG11  VAL  20          HG11      VAL  20  -0.818   6.343  12.365
  156   HG12  VAL  20          HG12      VAL  20  -0.866   6.338  14.162
  157   HG13  VAL  20          HG13      VAL  20  -1.496   4.938  13.166
  158   HG21  VAL  20          HG21      VAL  20   0.315   3.980  15.123
  159   HG22  VAL  20          HG22      VAL  20   1.521   3.233  14.095
  160   HG23  VAL  20          HG23      VAL  20  -0.185   3.111  13.642
  161    H    GLU  21           H        GLU  21   0.784   7.046  12.646
  162    HA   GLU  21           HA       GLU  21   1.500   8.485  10.323
  163    HB2  GLU  21           HB3      GLU  21   1.919  10.102  12.681
  164    HB3  GLU  21           HB2      GLU  21   0.704  10.250  11.334
  165    HG2  GLU  21           HG3      GLU  21  -0.759   8.596  12.403
  166    HG3  GLU  21           HG2      GLU  21   0.473   8.377  13.740
  167    H    LYS  22           H        LYS  22   3.334   9.614   9.785
  168    HA   LYS  22           HA       LYS  22   5.863   8.453  10.239
  169    HB2  LYS  22           HB3      LYS  22   5.117  10.158   8.492
  170    HB3  LYS  22           HB2      LYS  22   5.534  11.386   9.624
  171    HG2  LYS  22           HG3      LYS  22   7.343   9.287   8.441
  172    HG3  LYS  22           HG2      LYS  22   7.492  11.014   8.243
  173    HD2  LYS  22           HD3      LYS  22   7.977   9.496  10.772
  174    HD3  LYS  22           HD2      LYS  22   9.183  10.343   9.739
  175    HE2  LYS  22           HE3      LYS  22   8.268  12.427  10.234
  176    HE3  LYS  22           HE2      LYS  22   6.906  11.758  11.060
  177    HZ1  LYS  22           HZ1      LYS  22   9.397  12.529  12.162
  178    HZ2  LYS  22           HZ2      LYS  22   9.223  10.820  12.206
  179    HZ3  LYS  22           HZ3      LYS  22   8.059  11.777  12.971
  180    H    GLY  23           H        GLY  23   7.041   8.353  12.050
  181    HA2  GLY  23           HA3      GLY  23   8.197  10.217  13.541
  182    HA3  GLY  23           HA2      GLY  23   6.530  10.336  14.174
  183    H    GLY  24           H        GLY  24   6.099   7.421  13.802
  184    HA2  GLY  24           HA3      GLY  24   7.256   6.506  16.276
  185    HA3  GLY  24           HA2      GLY  24   6.153   5.609  15.243
  186    H    LYS  25           H        LYS  25   7.078   3.704  14.696
  187    HA   LYS  25           HA       LYS  25   9.887   3.709  14.048
  188    HB2  LYS  25           HB3      LYS  25   8.795   1.114  14.500
  189    HB3  LYS  25           HB2      LYS  25  10.213   1.811  15.223
  190    HG2  LYS  25           HG3      LYS  25   9.041   2.528  16.976
  191    HG3  LYS  25           HG2      LYS  25   7.494   2.795  16.123
  192    HD2  LYS  25           HD3      LYS  25   8.767   0.164  17.041
  193    HD3  LYS  25           HD2      LYS  25   7.264   0.903  17.703
  194    HE2  LYS  25           HE3      LYS  25   5.991   0.021  16.213
  195    HE3  LYS  25           HE2      LYS  25   6.972   0.711  14.951
  196    HZ1  LYS  25           HZ1      LYS  25   6.945  -2.054  15.906
  197    HZ2  LYS  25           HZ2      LYS  25   8.535  -1.363  15.685
  198    HZ3  LYS  25           HZ3      LYS  25   7.449  -1.369  14.412
  199    H    HIS  26           H        HIS  26  10.621   2.326  12.310
  200    HA   HIS  26           HA       HIS  26   9.046   2.622   9.995
  201    HB2  HIS  26           HB3      HIS  26  10.942   0.523   9.600
  202    HB3  HIS  26           HB2      HIS  26  11.005   2.182   9.017
  203    HD1  HIS  26           HD1      HIS  26  11.696   0.468  12.356
  204    HD2  HIS  26           HD2      HIS  26  13.266   3.383   9.844
  205    HE1  HIS  26           HE1      HIS  26  13.791   1.274  13.489
  206    HE2  HIS  26           HE2      HIS  26  14.672   3.104  11.997
  207    H    LYS  27           H        LYS  27   7.786   1.276   8.822
  208    HA   LYS  27           HA       LYS  27   6.726  -0.966  10.315
  209    HB2  LYS  27           HB3      LYS  27   4.793  -0.860   8.972
  210    HB3  LYS  27           HB2      LYS  27   5.372   0.824   8.869
  211    HG2  LYS  27           HG3      LYS  27   6.748  -0.471   6.878
  212    HG3  LYS  27           HG2      LYS  27   5.139  -1.139   6.774
  213    HD2  LYS  27           HD3      LYS  27   5.603   0.990   5.453
  214    HD3  LYS  27           HD2      LYS  27   4.117   0.872   6.445
  215    HE2  LYS  27           HE3      LYS  27   4.756   2.618   7.709
  216    HE3  LYS  27           HE2      LYS  27   6.396   1.896   7.997
  217    HZ1  LYS  27           HZ1      LYS  27   7.199   2.872   6.021
  218    HZ2  LYS  27           HZ2      LYS  27   6.360   4.065   6.832
  219    HZ3  LYS  27           HZ3      LYS  27   5.698   3.404   5.465
  220    H    THR  28           H        THR  28   6.036  -2.947   8.930
  221    HA   THR  28           HA       THR  28   8.508  -4.196   8.139
  222    HB   THR  28           HB       THR  28   5.917  -5.376   7.343
  223    HG1  THR  28           HG1      THR  28   6.709  -5.481  10.054
  224   HG21  THR  28          HG21      THR  28   6.852  -7.383   7.900
  225   HG22  THR  28          HG22      THR  28   7.947  -6.691   8.930
  226   HG23  THR  28          HG23      THR  28   8.218  -6.549   7.241
  227    H    GLY  29           H        GLY  29   5.711  -2.842   6.376
  228    HA2  GLY  29           HA3      GLY  29   7.371  -2.933   3.937
  229    HA3  GLY  29           HA2      GLY  29   5.718  -3.505   3.839
  230    HA   PRO  30           HA       PRO  30   6.637   1.296   3.267
  231    HB2  PRO  30           HB3      PRO  30   5.501   0.333   0.609
  232    HB3  PRO  30           HB2      PRO  30   6.679   1.661   0.875
  233    HG2  PRO  30           HG3      PRO  30   7.579  -0.636   0.058
  234    HG3  PRO  30           HG2      PRO  30   8.470   0.226   1.231
  235    HD2  PRO  30           HD3      PRO  30   6.893  -2.248   1.598
  236    HD3  PRO  30           HD2      PRO  30   8.291  -1.656   2.491
  237    H    ASN  31           H        ASN  31   4.994   2.353   4.069
  238    HA   ASN  31           HA       ASN  31   2.423   1.343   4.447
  239    HB2  ASN  31           HB3      ASN  31   3.722   3.437   5.454
  240    HB3  ASN  31           HB2      ASN  31   2.730   4.306   4.261
  241   HD21  ASN  31          HD21      ASN  31   2.018   5.231   6.463
  242   HD22  ASN  31          HD22      ASN  31   0.703   4.497   7.141
  243    H    LEU  32           H        LEU  32   3.297   3.930   2.199
  244    HA   LEU  32           HA       LEU  32   1.838   2.923   0.159
  245    HB2  LEU  32           HB3      LEU  32  -0.059   4.432  -0.104
  246    HB3  LEU  32           HB2      LEU  32  -0.095   3.472   1.365
  247    HG   LEU  32           HG       LEU  32  -1.145   5.601   1.928
  248   HD11  LEU  32          HD11      LEU  32   1.519   5.229   2.869
  249   HD12  LEU  32          HD12      LEU  32   0.092   4.548   3.648
  250   HD13  LEU  32          HD13      LEU  32   0.359   6.290   3.669
  251   HD21  LEU  32          HD21      LEU  32  -0.372   7.563   1.166
  252   HD22  LEU  32          HD22      LEU  32   0.298   6.487  -0.060
  253   HD23  LEU  32          HD23      LEU  32   1.289   7.005   1.310
  254    H    HIS  33           H        HIS  33   3.339   5.629   1.698
  255    HA   HIS  33           HA       HIS  33   3.443   7.587  -0.223
  256    HB2  HIS  33           HB3      HIS  33   4.735   7.084   2.202
  257    HB3  HIS  33           HB2      HIS  33   6.040   7.273   1.036
  258    HD1  HIS  33           HD1      HIS  33   6.684   9.519   2.217
  259    HD2  HIS  33           HD2      HIS  33   2.913   9.485   0.471
  260    HE1  HIS  33           HE1      HIS  33   5.966  11.926   2.122
  261    HE2  HIS  33           HE2      HIS  33   3.646  11.873   1.141
  262    H    GLY  34           H        GLY  34   4.189   7.703  -2.171
  263    HA2  GLY  34           HA3      GLY  34   5.464   7.305  -4.071
  264    HA3  GLY  34           HA2      GLY  34   6.663   6.478  -2.990
  265    H    LEU  35           H        LEU  35   3.463   5.354  -2.845
  266    HA   LEU  35           HA       LEU  35   4.176   2.715  -3.610
  267    HB2  LEU  35           HB3      LEU  35   2.280   3.285  -2.255
  268    HB3  LEU  35           HB2      LEU  35   1.457   3.942  -3.619
  269    HG   LEU  35           HG       LEU  35   1.349   1.715  -4.570
  270   HD11  LEU  35          HD11      LEU  35   2.483  -0.067  -3.894
  271   HD12  LEU  35          HD12      LEU  35   2.315   0.392  -2.195
  272   HD13  LEU  35          HD13      LEU  35   3.518   1.153  -3.228
  273   HD21  LEU  35          HD21      LEU  35   0.371   2.072  -1.783
  274   HD22  LEU  35          HD22      LEU  35   0.064   0.578  -2.733
  275   HD23  LEU  35          HD23      LEU  35  -0.500   2.055  -3.383
  276    H    PHE  36           H        PHE  36   2.368   5.306  -5.385
  277    HA   PHE  36           HA       PHE  36   2.779   3.703  -7.867
  278    HB2  PHE  36           HB3      PHE  36   0.885   6.021  -7.839
  279    HB3  PHE  36           HB2      PHE  36   0.757   4.539  -8.615
  280    HD1  PHE  36           HD1      PHE  36  -0.305   2.610  -7.744
  281    HD2  PHE  36           HD2      PHE  36   0.292   6.200  -5.421
  282    HE1  PHE  36           HE1      PHE  36  -1.780   1.759  -5.940
  283    HE2  PHE  36           HE2      PHE  36  -1.265   5.343  -3.696
  284    HZ   PHE  36           HZ       PHE  36  -2.318   3.111  -4.044
  285    H    GLY  37           H        GLY  37   4.459   5.755  -6.351
  286    HA2  GLY  37           HA3      GLY  37   5.065   7.458  -8.724
  287    HA3  GLY  37           HA2      GLY  37   5.167   8.122  -7.047
  288    H    ARG  38           H        ARG  38   6.435   5.839  -5.900
  289    HA   ARG  38           HA       ARG  38   9.143   6.284  -6.862
  290    HB2  ARG  38           HB3      ARG  38   8.054   4.886  -4.416
  291    HB3  ARG  38           HB2      ARG  38   9.768   4.983  -4.801
  292    HG2  ARG  38           HG3      ARG  38   9.451   7.509  -4.836
  293    HG3  ARG  38           HG2      ARG  38   7.893   7.205  -4.066
  294    HD2  ARG  38           HD3      ARG  38   8.865   6.929  -2.086
  295    HD3  ARG  38           HD2      ARG  38   9.953   5.707  -2.742
  296    HE   ARG  38           HE       ARG  38  11.566   7.285  -2.455
  297   HH11  ARG  38          HH11      ARG  38   8.652   8.877  -3.500
  298   HH12  ARG  38          HH12      ARG  38   9.386  10.443  -3.595
  299   HH21  ARG  38          HH21      ARG  38  12.544   9.341  -2.575
  300   HH22  ARG  38          HH22      ARG  38  11.600  10.707  -3.069
  301    H    LYS  39           H        LYS  39  10.594   4.328  -6.836
  302    HA   LYS  39           HA       LYS  39   9.873   2.569  -8.846
  303    HB2  LYS  39           HB3      LYS  39  12.229   2.971  -8.257
  304    HB3  LYS  39           HB2      LYS  39  11.994   2.141  -6.732
  305    HG2  LYS  39           HG3      LYS  39  12.997   1.113  -9.055
  306    HG3  LYS  39           HG2      LYS  39  12.314   0.160  -7.783
  307    HD2  LYS  39           HD3      LYS  39  11.267  -0.476  -9.967
  308    HD3  LYS  39           HD2      LYS  39  10.049   0.266  -8.857
  309    HE2  LYS  39           HE3      LYS  39  10.697   2.456  -9.996
  310    HE3  LYS  39           HE2      LYS  39  11.502   1.407 -11.217
  311    HZ1  LYS  39           HZ1      LYS  39   9.451   0.649 -11.975
  312    HZ2  LYS  39           HZ2      LYS  39   8.980   2.136 -11.420
  313    HZ3  LYS  39           HZ3      LYS  39   8.733   0.704 -10.478
  314    H    THR  40           H        THR  40  10.929   0.885  -5.964
  315    HA   THR  40           HA       THR  40   8.420   0.016  -5.227
  316    HB   THR  40           HB       THR  40   8.919  -2.252  -5.000
  317    HG1  THR  40           HG1      THR  40  10.399  -3.447  -5.904
  318   HG21  THR  40          HG21      THR  40   8.597  -2.010  -7.751
  319   HG22  THR  40          HG22      THR  40   8.883  -2.847  -6.540
  320   HG23  THR  40          HG23      THR  40   7.492  -2.865  -6.237
  321    H    GLY  41           H        GLY  41   8.317   0.409  -3.429
  322    HA2  GLY  41           HA3      GLY  41   8.798   0.423  -1.185
  323    HA3  GLY  41           HA2      GLY  41   9.453  -1.182  -1.465
  324    H    GLN  42           H        GLN  42  10.747   1.834  -2.753
  325    HA   GLN  42           HA       GLN  42  13.243   1.317  -1.456
  326    HB2  GLN  42           HB3      GLN  42  13.775   3.318  -3.223
  327    HB3  GLN  42           HB2      GLN  42  13.940   1.626  -3.566
  328    HG2  GLN  42           HG3      GLN  42  12.718   2.828  -5.315
  329    HG3  GLN  42           HG2      GLN  42  11.869   1.523  -4.652
  330   HE21  GLN  42          HE21      GLN  42   9.788   2.045  -4.670
  331   HE22  GLN  42          HE22      GLN  42   9.121   3.505  -4.144
  332    H    ALA  43           H        ALA  43  11.271   2.273   0.205
  333    HA   ALA  43           HA       ALA  43  11.059   5.073   0.415
  334    HB1  ALA  43           HB1      ALA  43  11.235   4.222   3.030
  335    HB2  ALA  43           HB2      ALA  43  10.650   2.792   2.165
  336    HB3  ALA  43           HB3      ALA  43   9.805   4.332   2.021
  337    HA   PRO  44           HA       PRO  44  14.944   6.483   2.027
  338    HB2  PRO  44           HB3      PRO  44  14.310   8.209   4.014
  339    HB3  PRO  44           HB2      PRO  44  13.842   8.581   2.339
  340    HG2  PRO  44           HG3      PRO  44  12.243   7.395   4.577
  341    HG3  PRO  44           HG2      PRO  44  11.747   8.617   3.380
  342    HD2  PRO  44           HD3      PRO  44  11.081   5.902   3.271
  343    HD3  PRO  44           HD2      PRO  44  11.246   7.073   1.796
  344    H    GLY  45           H        GLY  45  14.070   7.070   5.241
  345    HA2  GLY  45           HA3      GLY  45  16.080   5.301   6.193
  346    HA3  GLY  45           HA2      GLY  45  14.864   6.257   7.208
  347    H    PHE  46           H        PHE  46  13.232   4.465   4.976
  348    HA   PHE  46           HA       PHE  46  12.299   2.662   7.026
  349    HB2  PHE  46           HB3      PHE  46  10.699   3.694   5.485
  350    HB3  PHE  46           HB2      PHE  46  11.502   2.921   4.121
  351    HD1  PHE  46           HD1      PHE  46   9.678   2.186   7.265
  352    HD2  PHE  46           HD2      PHE  46  10.860   0.798   3.423
  353    HE1  PHE  46           HE1      PHE  46   8.221   0.221   7.532
  354    HE2  PHE  46           HE2      PHE  46   9.406  -1.168   3.682
  355    HZ   PHE  46           HZ       PHE  46   8.084  -1.460   5.737
  356    H    THR  47           H        THR  47  12.754   0.515   7.200
  357    HA   THR  47           HA       THR  47  14.917  -0.548   5.699
  358    HB   THR  47           HB       THR  47  13.962  -0.949   8.259
  359    HG1  THR  47           HG1      THR  47  15.627  -2.507   8.336
  360   HG21  THR  47          HG21      THR  47  13.629  -3.385   8.379
  361   HG22  THR  47          HG22      THR  47  13.388  -3.379   6.607
  362   HG23  THR  47          HG23      THR  47  12.219  -2.500   7.724
  363    H    TYR  48           H        TYR  48  14.395  -1.063   3.661
  364    HA   TYR  48           HA       TYR  48  11.880  -2.238   2.882
  365    HB2  TYR  48           HB3      TYR  48  13.774  -2.690   0.930
  366    HB3  TYR  48           HB2      TYR  48  12.555  -1.501   0.884
  367    HD1  TYR  48           HD1      TYR  48  15.991  -2.060   2.266
  368    HD2  TYR  48           HD2      TYR  48  13.178   0.750   0.828
  369    HE1  TYR  48           HE1      TYR  48  17.709  -0.305   2.383
  370    HE2  TYR  48           HE2      TYR  48  14.895   2.534   0.894
  371    HH   TYR  48           HH       TYR  48  17.933   1.964   2.385
  372    H    THR  49           H        THR  49  11.599  -4.212   1.774
  373    HA   THR  49           HA       THR  49  12.852  -6.377   3.269
  374    HB   THR  49           HB       THR  49  11.219  -7.810   2.195
  375    HG1  THR  49           HG1      THR  49   9.787  -6.756   0.589
  376   HG21  THR  49          HG21      THR  49   9.357  -5.620   2.313
  377   HG22  THR  49          HG22      THR  49  10.469  -5.645   3.749
  378   HG23  THR  49          HG23      THR  49   9.468  -7.100   3.307
  379    H    ASP  50           H        ASP  50  13.538  -8.386   1.869
  380    HA   ASP  50           HA       ASP  50  15.818  -7.726   0.439
  381    HB2  ASP  50           HB3      ASP  50  15.842  -9.936   1.102
  382    HB3  ASP  50           HB2      ASP  50  14.151 -10.191   0.680
  383    H    ALA  51           H        ALA  51  12.553  -8.160  -0.697
  384    HA   ALA  51           HA       ALA  51  13.143  -8.083  -3.451
  385    HB1  ALA  51           HB1      ALA  51  10.936  -8.721  -3.597
  386    HB2  ALA  51           HB2      ALA  51  10.434  -7.202  -2.935
  387    HB3  ALA  51           HB3      ALA  51  10.849  -8.556  -1.875
  388    H    ASN  52           H        ASN  52  11.951  -5.645  -1.061
  389    HA   ASN  52           HA       ASN  52  11.738  -3.540  -2.911
  390    HB2  ASN  52           HB3      ASN  52  12.395  -3.545   0.020
  391    HB3  ASN  52           HB2      ASN  52  11.908  -2.086  -0.960
  392   HD21  ASN  52          HD21      ASN  52  10.144  -4.150  -2.462
  393   HD22  ASN  52          HD22      ASN  52   8.723  -4.159  -1.443
  394    H    LYS  53           H        LYS  53  14.459  -4.606  -1.021
  395    HA   LYS  53           HA       LYS  53  16.255  -2.517  -1.713
  396    HB2  LYS  53           HB3      LYS  53  18.026  -4.164  -1.163
  397    HB3  LYS  53           HB2      LYS  53  16.820  -3.885   0.063
  398    HG2  LYS  53           HG3      LYS  53  15.724  -5.893  -0.364
  399    HG3  LYS  53           HG2      LYS  53  16.724  -6.170  -1.825
  400    HD2  LYS  53           HD3      LYS  53  17.810  -7.605  -0.371
  401    HD3  LYS  53           HD2      LYS  53  18.728  -6.054  -0.107
  402    HE2  LYS  53           HE3      LYS  53  18.176  -6.121   2.011
  403    HE3  LYS  53           HE2      LYS  53  16.497  -6.020   1.626
  404    HZ1  LYS  53           HZ1      LYS  53  17.997  -8.240   2.629
  405    HZ2  LYS  53           HZ2      LYS  53  17.157  -8.628   1.117
  406    HZ3  LYS  53           HZ3      LYS  53  16.264  -8.054   2.533
  407    H    ASN  54           H        ASN  54  15.227  -5.445  -3.373
  408    HA   ASN  54           HA       ASN  54  17.297  -5.329  -5.376
  409    HB2  ASN  54           HB3      ASN  54  14.647  -6.788  -5.359
  410    HB3  ASN  54           HB2      ASN  54  16.009  -7.063  -6.471
  411   HD21  ASN  54          HD21      ASN  54  17.326  -6.299  -3.608
  412   HD22  ASN  54          HD22      ASN  54  17.585  -7.942  -2.971
  413    H    LYS  55           H        LYS  55  14.381  -3.662  -4.833
  414    HA   LYS  55           HA       LYS  55  13.312  -1.931  -5.895
  415    HB2  LYS  55           HB3      LYS  55  15.649  -2.483  -7.786
  416    HB3  LYS  55           HB2      LYS  55  14.393  -1.268  -8.170
  417    HG2  LYS  55           HG3      LYS  55  15.211   0.266  -6.736
  418    HG3  LYS  55           HG2      LYS  55  15.520  -1.049  -5.497
  419    HD2  LYS  55           HD3      LYS  55  17.245  -0.195  -7.829
  420    HD3  LYS  55           HD2      LYS  55  17.646  -0.095  -6.113
  421    HE2  LYS  55           HE3      LYS  55  17.249  -2.698  -6.247
  422    HE3  LYS  55           HE2      LYS  55  17.582  -2.449  -7.999
  423    HZ1  LYS  55           HZ1      LYS  55  19.575  -2.933  -7.073
  424    HZ2  LYS  55           HZ2      LYS  55  19.395  -2.034  -5.690
  425    HZ3  LYS  55           HZ3      LYS  55  19.582  -1.267  -7.151
  426    H    GLY  56           H        GLY  56  11.838  -4.050  -5.993
  427    HA2  GLY  56           HA3      GLY  56  11.502  -5.534  -8.257
  428    HA3  GLY  56           HA2      GLY  56  10.163  -5.132  -7.116
  429    H    ILE  57           H        ILE  57   8.642  -3.738  -7.713
  430    HA   ILE  57           HA       ILE  57   9.166  -1.943  -9.914
  431    HB   ILE  57           HB       ILE  57   7.953  -4.285 -10.564
  432   HG12  ILE  57          HG13      ILE  57   8.872  -3.124 -12.333
  433   HG13  ILE  57          HG12      ILE  57   7.208  -2.848 -12.602
  434   HG21  ILE  57          HG21      ILE  57   5.855  -3.982  -9.529
  435   HG22  ILE  57          HG22      ILE  57   5.648  -3.570 -11.245
  436   HG23  ILE  57          HG23      ILE  57   5.866  -2.207 -10.093
  437   HD11  ILE  57          HD11      ILE  57   7.451  -0.582 -12.056
  438   HD12  ILE  57          HD12      ILE  57   9.081  -0.892 -12.538
  439   HD13  ILE  57          HD13      ILE  57   8.628  -0.974 -10.800
  440    H    THR  58           H        THR  58   7.114  -0.485 -10.367
  441    HA   THR  58           HA       THR  58   6.244   0.509  -7.844
  442    HB   THR  58           HB       THR  58   6.729   1.576 -10.392
  443    HG1  THR  58           HG1      THR  58   6.217   3.517  -9.344
  444   HG21  THR  58          HG21      THR  58   4.370   1.037 -10.950
  445   HG22  THR  58          HG22      THR  58   4.775   2.777 -11.017
  446   HG23  THR  58          HG23      THR  58   3.873   2.079  -9.633
  447    H    TRP  59           H        TRP  59   4.590  -0.186  -6.881
  448    HA   TRP  59           HA       TRP  59   2.658  -1.907  -8.037
  449    HB2  TRP  59           HB3      TRP  59   1.938  -0.546  -5.505
  450    HB3  TRP  59           HB2      TRP  59   1.965  -2.216  -5.819
  451    HD1  TRP  59           HD1      TRP  59   4.398   0.591  -4.847
  452    HE1  TRP  59           HE1      TRP  59   6.438  -0.509  -3.729
  453    HE3  TRP  59           HE3      TRP  59   3.228  -4.320  -5.596
  454    HZ2  TRP  59           HZ2      TRP  59   7.411  -3.164  -3.233
  455    HZ3  TRP  59           HZ3      TRP  59   4.792  -6.059  -4.749
  456    HH2  TRP  59           HH2      TRP  59   6.876  -5.468  -3.632
  457    H    LYS  60           H        LYS  60   1.251  -1.223  -9.452
  458    HA   LYS  60           HA       LYS  60   0.012   1.479  -9.178
  459    HB2  LYS  60           HB3      LYS  60   0.359   1.517 -11.344
  460    HB3  LYS  60           HB2      LYS  60   1.001  -0.075 -11.411
  461    HG2  LYS  60           HG3      LYS  60  -0.738  -0.452 -12.783
  462    HG3  LYS  60           HG2      LYS  60  -1.713  -0.526 -11.352
  463    HD2  LYS  60           HD3      LYS  60  -2.819   1.393 -11.688
  464    HD3  LYS  60           HD2      LYS  60  -1.354   2.266 -12.193
  465    HE2  LYS  60           HE3      LYS  60  -1.989   0.279 -14.158
  466    HE3  LYS  60           HE2      LYS  60  -3.438   1.179 -13.801
  467    HZ1  LYS  60           HZ1      LYS  60  -1.528   1.993 -15.496
  468    HZ2  LYS  60           HZ2      LYS  60  -1.142   2.902 -14.020
  469    HZ3  LYS  60           HZ3      LYS  60  -2.724   3.042 -14.723
  470    H    GLU  61           H        GLU  61  -2.308   1.531 -10.032
  471    HA   GLU  61           HA       GLU  61  -3.900  -0.066  -8.297
  472    HB2  GLU  61           HB3      GLU  61  -4.282   2.173  -9.963
  473    HB3  GLU  61           HB2      GLU  61  -5.326   0.936 -10.629
  474    HG2  GLU  61           HG3      GLU  61  -5.606   0.886  -7.810
  475    HG3  GLU  61           HG2      GLU  61  -5.738   2.608  -8.394
  476    H    GLU  62           H        GLU  62  -3.683  -0.271 -11.881
  477    HA   GLU  62           HA       GLU  62  -5.296  -2.525 -12.101
  478    HB2  GLU  62           HB3      GLU  62  -4.810  -2.529 -14.323
  479    HB3  GLU  62           HB2      GLU  62  -4.362  -0.862 -13.850
  480    HG2  GLU  62           HG3      GLU  62  -2.015  -1.418 -13.658
  481    HG3  GLU  62           HG2      GLU  62  -2.460  -3.047 -14.264
  482    H    THR  63           H        THR  63  -1.782  -2.136 -11.852
  483    HA   THR  63           HA       THR  63  -1.116  -4.834 -12.188
  484    HB   THR  63           HB       THR  63   0.283  -2.480 -11.648
  485    HG1  THR  63           HG1      THR  63   1.549  -3.566 -12.894
  486   HG21  THR  63          HG21      THR  63   1.730  -2.798 -10.021
  487   HG22  THR  63          HG22      THR  63   1.500  -4.572  -9.915
  488   HG23  THR  63          HG23      THR  63   0.311  -3.421  -9.281
  489    H    LEU  64           H        LEU  64  -2.218  -3.091  -9.461
  490    HA   LEU  64           HA       LEU  64  -1.478  -5.017  -7.426
  491    HB2  LEU  64           HB3      LEU  64  -2.936  -2.508  -7.603
  492    HB3  LEU  64           HB2      LEU  64  -3.595  -3.592  -6.489
  493    HG   LEU  64           HG       LEU  64  -0.828  -2.592  -6.452
  494   HD11  LEU  64          HD11      LEU  64  -1.889  -0.866  -5.472
  495   HD12  LEU  64          HD12      LEU  64  -1.835  -1.883  -4.128
  496   HD13  LEU  64          HD13      LEU  64  -3.286  -1.835  -5.004
  497   HD21  LEU  64          HD21      LEU  64  -0.552  -3.895  -4.384
  498   HD22  LEU  64          HD22      LEU  64  -1.072  -4.926  -5.701
  499   HD23  LEU  64          HD23      LEU  64  -2.185  -4.448  -4.501
  500    H    MET  65           H        MET  65  -4.323  -4.489  -9.523
  501    HA   MET  65           HA       MET  65  -6.108  -6.188  -8.164
  502    HB2  MET  65           HB3      MET  65  -5.775  -5.350 -11.071
  503    HB3  MET  65           HB2      MET  65  -7.088  -6.359 -10.521
  504    HG2  MET  65           HG3      MET  65  -6.532  -3.484  -9.738
  505    HG3  MET  65           HG2      MET  65  -7.943  -4.114 -10.641
  506    HE1  MET  65           HE1      MET  65  -6.424  -3.107  -7.406
  507    HE2  MET  65           HE2      MET  65  -6.043  -4.710  -7.153
  508    HE3  MET  65           HE3      MET  65  -7.228  -3.943  -6.110
  509    H    GLU  66           H        GLU  66  -3.689  -6.812 -10.711
  510    HA   GLU  66           HA       GLU  66  -4.346  -9.608 -10.877
  511    HB2  GLU  66           HB3      GLU  66  -2.112  -9.645 -12.176
  512    HB3  GLU  66           HB2      GLU  66  -3.469  -8.770 -12.873
  513    HG2  GLU  66           HG3      GLU  66  -2.556  -6.670 -12.118
  514    HG3  GLU  66           HG2      GLU  66  -1.240  -7.507 -11.293
  515    H    TYR  67           H        TYR  67  -1.941  -7.622  -9.264
  516    HA   TYR  67           HA       TYR  67  -0.242  -9.665  -8.357
  517    HB2  TYR  67           HB3      TYR  67   0.756  -7.638  -8.032
  518    HB3  TYR  67           HB2      TYR  67  -0.759  -6.836  -7.638
  519    HD1  TYR  67           HD1      TYR  67   2.138  -8.588  -6.320
  520    HD2  TYR  67           HD2      TYR  67  -1.669  -6.954  -5.348
  521    HE1  TYR  67           HE1      TYR  67   2.719  -8.667  -3.931
  522    HE2  TYR  67           HE2      TYR  67  -1.096  -7.027  -2.957
  523    HH   TYR  67           HH       TYR  67   0.725  -7.179  -1.503
  524    H    LEU  68           H        LEU  68  -3.373  -8.669  -7.373
  525    HA   LEU  68           HA       LEU  68  -3.299  -9.548  -4.647
  526    HB2  LEU  68           HB3      LEU  68  -5.552  -9.182  -6.660
  527    HB3  LEU  68           HB2      LEU  68  -5.819  -9.795  -5.130
  528    HG   LEU  68           HG       LEU  68  -4.621  -7.163  -5.503
  529   HD11  LEU  68          HD11      LEU  68  -6.686  -6.143  -5.122
  530   HD12  LEU  68          HD12      LEU  68  -7.447  -7.701  -4.840
  531   HD13  LEU  68          HD13      LEU  68  -6.939  -7.288  -6.467
  532   HD21  LEU  68          HD21      LEU  68  -4.064  -8.102  -3.415
  533   HD22  LEU  68          HD22      LEU  68  -5.750  -8.441  -3.152
  534   HD23  LEU  68          HD23      LEU  68  -5.207  -6.763  -3.168
  535    H    GLU  69           H        GLU  69  -3.163 -11.253  -7.534
  536    HA   GLU  69           HA       GLU  69  -4.586 -13.601  -6.854
  537    HB2  GLU  69           HB3      GLU  69  -3.176 -12.731  -9.087
  538    HB3  GLU  69           HB2      GLU  69  -2.144 -14.050  -8.510
  539    HG2  GLU  69           HG3      GLU  69  -4.004 -15.607  -8.556
  540    HG3  GLU  69           HG2      GLU  69  -5.066 -14.307  -9.188
  541    H    ASN  70           H        ASN  70  -1.035 -13.553  -7.202
  542    HA   ASN  70           HA       ASN  70  -0.862 -15.111  -4.707
  543    HB2  ASN  70           HB3      ASN  70   0.549 -15.408  -7.331
  544    HB3  ASN  70           HB2      ASN  70   1.368 -15.907  -5.852
  545   HD21  ASN  70          HD21      ASN  70  -0.970 -16.688  -8.194
  546   HD22  ASN  70          HD22      ASN  70  -1.506 -18.179  -7.504
  547    HA   PRO  71           HA       PRO  71   1.188 -11.130  -3.674
  548    HB2  PRO  71           HB3      PRO  71   1.106 -12.613  -1.037
  549    HB3  PRO  71           HB2      PRO  71   0.698 -10.888  -1.384
  550    HG2  PRO  71           HG3      PRO  71  -1.138 -12.751  -0.939
  551    HG3  PRO  71           HG2      PRO  71  -1.342 -11.493  -2.256
  552    HD2  PRO  71           HD3      PRO  71  -0.715 -14.331  -2.550
  553    HD3  PRO  71           HD2      PRO  71  -1.706 -13.342  -3.560
  554    H    LYS  72           H        LYS  72   2.134 -14.454  -2.920
  555    HA   LYS  72           HA       LYS  72   4.786 -13.694  -2.282
  556    HB2  LYS  72           HB3      LYS  72   4.841 -15.748  -1.317
  557    HB3  LYS  72           HB2      LYS  72   3.152 -16.010  -1.892
  558    HG2  LYS  72           HG3      LYS  72   4.092 -17.855  -2.772
  559    HG3  LYS  72           HG2      LYS  72   4.380 -16.723  -4.093
  560    HD2  LYS  72           HD3      LYS  72   6.500 -16.392  -2.280
  561    HD3  LYS  72           HD2      LYS  72   6.376 -18.135  -2.719
  562    HE2  LYS  72           HE3      LYS  72   6.058 -16.693  -5.166
  563    HE3  LYS  72           HE2      LYS  72   7.457 -16.003  -4.284
  564    HZ1  LYS  72           HZ1      LYS  72   8.340 -18.212  -4.157
  565    HZ2  LYS  72           HZ2      LYS  72   8.071 -17.813  -5.799
  566    HZ3  LYS  72           HZ3      LYS  72   7.033 -18.893  -4.859
  567    H    LYS  73           H        LYS  73   2.982 -14.583  -5.112
  568    HA   LYS  73           HA       LYS  73   5.179 -15.510  -6.668
  569    HB2  LYS  73           HB3      LYS  73   3.726 -15.589  -8.436
  570    HB3  LYS  73           HB2      LYS  73   2.617 -15.630  -7.059
  571    HG2  LYS  73           HG3      LYS  73   1.537 -14.071  -8.188
  572    HG3  LYS  73           HG2      LYS  73   2.680 -13.024  -7.372
  573    HD2  LYS  73           HD3      LYS  73   2.272 -12.703  -9.829
  574    HD3  LYS  73           HD2      LYS  73   3.933 -12.824  -9.309
  575    HE2  LYS  73           HE3      LYS  73   3.476 -14.249 -11.334
  576    HE3  LYS  73           HE2      LYS  73   4.180 -15.096 -10.046
  577    HZ1  LYS  73           HZ1      LYS  73   1.815 -15.680  -9.410
  578    HZ2  LYS  73           HZ2      LYS  73   2.452 -16.390 -10.806
  579    HZ3  LYS  73           HZ3      LYS  73   1.406 -15.140 -10.900
  580    H    TYR  74           H        TYR  74   3.946 -12.359  -5.936
  581    HA   TYR  74           HA       TYR  74   5.421 -10.959  -7.969
  582    HB2  TYR  74           HB3      TYR  74   3.471 -10.190  -5.794
  583    HB3  TYR  74           HB2      TYR  74   4.749  -8.986  -6.213
  584    HD1  TYR  74           HD1      TYR  74   2.156 -11.305  -7.838
  585    HD2  TYR  74           HD2      TYR  74   4.369  -7.581  -8.144
  586    HE1  TYR  74           HE1      TYR  74   0.876 -10.699  -9.756
  587    HE2  TYR  74           HE2      TYR  74   3.092  -6.982 -10.094
  588    HH   TYR  74           HH       TYR  74   0.821  -9.204 -11.610
  589    H    ILE  75           H        ILE  75   5.667 -11.390  -4.404
  590    HA   ILE  75           HA       ILE  75   8.499 -10.619  -4.567
  591    HB   ILE  75           HB       ILE  75   6.425  -9.676  -2.594
  592   HG12  ILE  75          HG13      ILE  75   6.588  -8.135  -4.281
  593   HG13  ILE  75          HG12      ILE  75   7.706  -7.512  -3.170
  594   HG21  ILE  75          HG21      ILE  75   8.505  -8.565  -1.443
  595   HG22  ILE  75          HG22      ILE  75   9.475  -9.752  -2.375
  596   HG23  ILE  75          HG23      ILE  75   8.284 -10.332  -1.273
  597   HD11  ILE  75          HD11      ILE  75   9.000  -7.392  -4.964
  598   HD12  ILE  75          HD12      ILE  75   8.103  -8.518  -5.886
  599   HD13  ILE  75          HD13      ILE  75   9.290  -9.152  -4.698
  600    HA   PRO  76           HA       PRO  76   7.972 -14.832  -2.671
  601    HB2  PRO  76           HB3      PRO  76  10.682 -15.045  -3.859
  602    HB3  PRO  76           HB2      PRO  76   9.326 -16.174  -3.940
  603    HG2  PRO  76           HG3      PRO  76  10.008 -14.698  -6.055
  604    HG3  PRO  76           HG2      PRO  76   8.307 -15.033  -5.681
  605    HD2  PRO  76           HD3      PRO  76   9.896 -12.541  -5.221
  606    HD3  PRO  76           HD2      PRO  76   8.207 -12.723  -5.744
  607    H    GLY  77           H        GLY  77   8.605 -15.268  -0.610
  608    HA2  GLY  77           HA3      GLY  77  10.376 -15.497   1.019
  609    HA3  GLY  77           HA2      GLY  77  11.132 -14.037   0.331
  610    H    THR  78           H        THR  78   8.225 -12.835   0.174
  611    HA   THR  78           HA       THR  78   8.345 -11.854   2.917
  612    HB   THR  78           HB       THR  78   8.175 -10.575   0.545
  613    HG1  THR  78           HG1      THR  78   7.227  -9.541   3.029
  614   HG21  THR  78          HG21      THR  78   5.705 -11.363   0.443
  615   HG22  THR  78          HG22      THR  78   6.073  -9.593   0.140
  616   HG23  THR  78          HG23      THR  78   5.498 -10.102   1.726
  617    H    LYS  79           H        LYS  79   6.819 -12.326   4.352
  618    HA   LYS  79           HA       LYS  79   4.407 -13.752   3.394
  619    HB2  LYS  79           HB3      LYS  79   6.141 -14.788   5.144
  620    HB3  LYS  79           HB2      LYS  79   5.338 -13.737   6.285
  621    HG2  LYS  79           HG3      LYS  79   4.500 -16.179   5.911
  622    HG3  LYS  79           HG2      LYS  79   3.270 -14.907   6.206
  623    HD2  LYS  79           HD3      LYS  79   2.804 -16.453   4.351
  624    HD3  LYS  79           HD2      LYS  79   2.934 -14.794   3.773
  625    HE2  LYS  79           HE3      LYS  79   4.064 -16.421   2.308
  626    HE3  LYS  79           HE2      LYS  79   5.158 -15.196   2.949
  627    HZ1  LYS  79           HZ1      LYS  79   6.043 -17.465   2.948
  628    HZ2  LYS  79           HZ2      LYS  79   4.802 -17.937   4.066
  629    HZ3  LYS  79           HZ3      LYS  79   6.009 -16.790   4.529
  630    H    MET  80           H        MET  80   2.329 -12.987   4.064
  631    HA   MET  80           HA       MET  80   2.383 -10.370   5.437
  632    HB2  MET  80           HB3      MET  80   1.291 -10.783   3.103
  633    HB3  MET  80           HB2      MET  80   0.065 -11.666   4.015
  634    HG2  MET  80           HG3      MET  80  -0.881  -9.519   3.965
  635    HG3  MET  80           HG2      MET  80  -0.048  -9.395   5.442
  636    HE1  MET  80           HE1      MET  80   2.084  -9.501   2.140
  637    HE2  MET  80           HE2      MET  80   1.912  -7.919   1.582
  638    HE3  MET  80           HE3      MET  80   0.537  -8.987   1.564
  639    H    ILE  81           H        ILE  81   2.087 -10.455   7.120
  640    HA   ILE  81           HA       ILE  81   0.243 -12.500   8.619
  641    HB   ILE  81           HB       ILE  81   2.241 -10.524   9.937
  642   HG12  ILE  81          HG13      ILE  81   3.132 -13.048  10.491
  643   HG13  ILE  81          HG12      ILE  81   2.263 -13.414   8.993
  644   HG21  ILE  81          HG21      ILE  81   1.202 -12.842  11.553
  645   HG22  ILE  81          HG22      ILE  81   0.121 -11.507  11.310
  646   HG23  ILE  81          HG23      ILE  81   1.708 -11.220  12.039
  647   HD11  ILE  81          HD11      ILE  81   4.320 -12.941   8.167
  648   HD12  ILE  81          HD12      ILE  81   4.699 -11.767   9.363
  649   HD13  ILE  81          HD13      ILE  81   3.568 -11.383   8.069
  650    H    PHE  82           H        PHE  82  -1.685 -11.882   9.765
  651    HA   PHE  82           HA       PHE  82  -3.225 -10.567  10.877
  652    HB2  PHE  82           HB3      PHE  82  -1.133  -9.093  11.420
  653    HB3  PHE  82           HB2      PHE  82  -1.759  -8.057  10.141
  654    HD1  PHE  82           HD1      PHE  82  -2.368  -9.400  13.495
  655    HD2  PHE  82           HD2      PHE  82  -3.767  -6.779  10.447
  656    HE1  PHE  82           HE1      PHE  82  -3.910  -8.359  15.104
  657    HE2  PHE  82           HE2      PHE  82  -5.311  -5.732  12.051
  658    HZ   PHE  82           HZ       PHE  82  -5.384  -6.522  14.383
  659    H    ALA  83           H        ALA  83  -4.866  -8.919  10.287
  660    HA   ALA  83           HA       ALA  83  -5.441  -7.457   8.155
  661    HB1  ALA  83           HB1      ALA  83  -6.186  -9.319   6.371
  662    HB2  ALA  83           HB2      ALA  83  -4.814 -10.243   7.096
  663    HB3  ALA  83           HB3      ALA  83  -4.460  -8.643   6.456
  664    H    GLY  84           H        GLY  84  -7.101  -7.090   9.616
  665    HA2  GLY  84           HA3      GLY  84  -9.158  -8.979  10.161
  666    HA3  GLY  84           HA2      GLY  84  -9.173  -7.356  10.662
  667    H    ILE  85           H        ILE  85  -8.558  -7.818   7.359
  668    HA   ILE  85           HA       ILE  85 -11.348  -7.504   6.645
  669    HB   ILE  85           HB       ILE  85  -9.053  -5.797   5.518
  670   HG12  ILE  85          HG13      ILE  85 -10.571  -5.432   7.746
  671   HG13  ILE  85          HG12      ILE  85  -9.609  -4.203   6.916
  672   HG21  ILE  85          HG21      ILE  85 -11.954  -5.731   4.763
  673   HG22  ILE  85          HG22      ILE  85 -10.692  -6.471   3.775
  674   HG23  ILE  85          HG23      ILE  85 -10.719  -4.718   4.188
  675   HD11  ILE  85          HD11      ILE  85 -11.745  -3.922   5.502
  676   HD12  ILE  85          HD12      ILE  85 -11.656  -3.213   7.111
  677   HD13  ILE  85          HD13      ILE  85 -12.586  -4.658   6.912
  678    H    LYS  86           H        LYS  86 -12.015  -8.261   4.612
  679    HA   LYS  86           HA       LYS  86 -10.018  -9.579   2.937
  680    HB2  LYS  86           HB3      LYS  86 -11.648 -11.615   2.956
  681    HB3  LYS  86           HB2      LYS  86 -10.257 -11.466   4.102
  682    HG2  LYS  86           HG3      LYS  86 -12.537 -10.139   5.229
  683    HG3  LYS  86           HG2      LYS  86 -13.000 -11.754   4.720
  684    HD2  LYS  86           HD3      LYS  86 -11.533 -12.811   6.132
  685    HD3  LYS  86           HD2      LYS  86 -10.483 -11.443   6.178
  686    HE2  LYS  86           HE3      LYS  86 -12.558 -10.307   7.373
  687    HE3  LYS  86           HE2      LYS  86 -13.033 -11.924   7.676
  688    HZ1  LYS  86           HZ1      LYS  86 -10.325 -10.997   8.384
  689    HZ2  LYS  86           HZ2      LYS  86 -11.131 -12.281   8.959
  690    HZ3  LYS  86           HZ3      LYS  86 -11.618 -10.718   9.477
  691    H    LYS  87           H        LYS  87 -13.407  -8.902   3.638
  692    HA   LYS  87           HA       LYS  87 -14.693  -9.479   1.401
  693    HB2  LYS  87           HB3      LYS  87 -14.989  -7.558   3.379
  694    HB3  LYS  87           HB2      LYS  87 -15.183  -6.654   1.884
  695    HG2  LYS  87           HG3      LYS  87 -17.300  -7.341   1.849
  696    HG3  LYS  87           HG2      LYS  87 -16.673  -9.059   1.589
  697    HD2  LYS  87           HD3      LYS  87 -16.537  -9.120   4.089
  698    HD3  LYS  87           HD2      LYS  87 -17.537  -7.694   4.179
  699    HE2  LYS  87           HE3      LYS  87 -18.830  -9.776   4.454
  700    HE3  LYS  87           HE2      LYS  87 -19.284  -8.726   3.099
  701    HZ1  LYS  87           HZ1      LYS  87 -19.077 -11.205   2.729
  702    HZ2  LYS  87           HZ2      LYS  87 -17.409 -10.894   2.582
  703    HZ3  LYS  87           HZ3      LYS  87 -18.511 -10.161   1.585
  704    H    LYS  88           H        LYS  88 -14.304  -9.339  -0.750
  705    HA   LYS  88           HA       LYS  88 -12.200  -7.913  -1.904
  706    HB2  LYS  88           HB3      LYS  88 -13.395  -9.740  -3.057
  707    HB3  LYS  88           HB2      LYS  88 -14.844  -8.698  -3.106
  708    HG2  LYS  88           HG3      LYS  88 -13.867  -7.281  -4.669
  709    HG3  LYS  88           HG2      LYS  88 -12.253  -7.924  -4.440
  710    HD2  LYS  88           HD3      LYS  88 -14.462  -8.850  -6.055
  711    HD3  LYS  88           HD2      LYS  88 -12.768  -9.082  -6.243
  712    HE2  LYS  88           HE3      LYS  88 -13.729 -11.227  -5.936
  713    HE3  LYS  88           HE2      LYS  88 -12.745 -10.812  -4.509
  714    HZ1  LYS  88           HZ1      LYS  88 -15.388 -11.593  -4.572
  715    HZ2  LYS  88           HZ2      LYS  88 -15.435  -9.961  -4.256
  716    HZ3  LYS  88           HZ3      LYS  88 -14.561 -10.945  -3.246
  717    H    THR  89           H        THR  89 -15.545  -6.912  -1.256
  718    HA   THR  89           HA       THR  89 -15.369  -4.442  -2.823
  719    HB   THR  89           HB       THR  89 -17.487  -4.028  -2.064
  720    HG1  THR  89           HG1      THR  89 -17.382  -3.755   0.078
  721   HG21  THR  89          HG21      THR  89 -17.382  -6.993  -1.352
  722   HG22  THR  89          HG22      THR  89 -17.433  -6.334  -3.019
  723   HG23  THR  89          HG23      THR  89 -18.791  -6.024  -1.871
  724    H    GLU  90           H        GLU  90 -14.464  -5.364   0.522
  725    HA   GLU  90           HA       GLU  90 -14.269  -2.697   1.439
  726    HB2  GLU  90           HB3      GLU  90 -13.066  -5.272   2.568
  727    HB3  GLU  90           HB2      GLU  90 -13.201  -3.737   3.378
  728    HG2  GLU  90           HG3      GLU  90 -15.704  -4.954   2.333
  729    HG3  GLU  90           HG2      GLU  90 -14.939  -5.800   3.562
  730    H    ARG  91           H        ARG  91 -11.961  -5.199   0.364
  731    HA   ARG  91           HA       ARG  91  -9.640  -3.667   0.743
  732    HB2  ARG  91           HB3      ARG  91 -10.196  -5.916  -1.218
  733    HB3  ARG  91           HB2      ARG  91  -8.612  -5.035  -1.075
  734    HG2  ARG  91           HG3      ARG  91  -9.066  -5.737   1.427
  735    HG3  ARG  91           HG2      ARG  91  -9.885  -7.121   0.666
  736    HD2  ARG  91           HD3      ARG  91  -7.264  -6.890  -0.614
  737    HD3  ARG  91           HD2      ARG  91  -7.156  -6.611   1.122
  738    HE   ARG  91           HE       ARG  91  -8.426  -8.798   1.147
  739   HH11  ARG  91          HH11      ARG  91  -6.010  -7.808  -1.161
  740   HH12  ARG  91          HH12      ARG  91  -5.521  -9.385  -1.560
  741   HH21  ARG  91          HH21      ARG  91  -7.780 -10.930   0.723
  742   HH22  ARG  91          HH22      ARG  91  -6.560 -11.202  -0.423
  743    H    GLU  92           H        GLU  92 -11.660  -4.155  -2.201
  744    HA   GLU  92           HA       GLU  92 -10.181  -2.522  -3.919
  745    HB2  GLU  92           HB3      GLU  92 -12.040  -4.119  -4.543
  746    HB3  GLU  92           HB2      GLU  92 -13.175  -2.885  -4.015
  747    HG2  GLU  92           HG3      GLU  92 -12.940  -2.785  -6.397
  748    HG3  GLU  92           HG2      GLU  92 -12.227  -1.339  -5.682
  749    H    ASP  93           H        ASP  93 -12.786  -1.743  -1.666
  750    HA   ASP  93           HA       ASP  93 -13.215   0.914  -2.426
  751    HB2  ASP  93           HB3      ASP  93 -14.821  -0.014  -0.920
  752    HB3  ASP  93           HB2      ASP  93 -13.578  -0.531   0.184
  753    H    GLY  94           H        GLY  94 -10.971  -0.421  -0.048
  754    HA2  GLY  94           HA3      GLY  94  -9.968   1.955   0.868
  755    HA3  GLY  94           HA2      GLY  94  -9.135   0.418   0.894
  756    H    ILE  95           H        ILE  95  -9.120   0.022  -1.895
  757    HA   ILE  95           HA       ILE  95  -6.711   1.272  -2.659
  758    HB   ILE  95           HB       ILE  95  -8.652  -0.444  -3.982
  759   HG12  ILE  95          HG13      ILE  95  -5.699  -0.451  -3.637
  760   HG13  ILE  95          HG12      ILE  95  -6.888  -1.429  -2.840
  761   HG21  ILE  95          HG21      ILE  95  -8.549   0.614  -5.907
  762   HG22  ILE  95          HG22      ILE  95  -6.910   0.065  -6.063
  763   HG23  ILE  95          HG23      ILE  95  -7.287   1.672  -5.402
  764   HD11  ILE  95          HD11      ILE  95  -6.540  -1.472  -5.867
  765   HD12  ILE  95          HD12      ILE  95  -7.285  -2.700  -4.823
  766   HD13  ILE  95          HD13      ILE  95  -5.548  -2.458  -4.764
  767    H    ALA  96           H        ALA  96 -10.116   2.012  -3.372
  768    HA   ALA  96           HA       ALA  96  -9.661   3.986  -5.301
  769    HB1  ALA  96           HB1      ALA  96 -11.878   3.196  -4.869
  770    HB2  ALA  96           HB2      ALA  96 -11.822   4.943  -4.690
  771    HB3  ALA  96           HB3      ALA  96 -11.775   3.791  -3.268
  772    H    TYR  97           H        TYR  97  -9.876   4.294  -1.807
  773    HA   TYR  97           HA       TYR  97  -9.445   7.063  -1.632
  774    HB2  TYR  97           HB3      TYR  97 -10.268   5.966   0.308
  775    HB3  TYR  97           HB2      TYR  97  -8.951   4.799   0.300
  776    HD1  TYR  97           HD1      TYR  97  -8.001   5.114   2.424
  777    HD2  TYR  97           HD2      TYR  97  -8.701   8.487  -0.072
  778    HE1  TYR  97           HE1      TYR  97  -6.738   6.527   3.989
  779    HE2  TYR  97           HE2      TYR  97  -7.439   9.910   1.486
  780    HH   TYR  97           HH       TYR  97  -5.625   8.574   4.136
  781    H    LEU  98           H        LEU  98  -7.228   4.343  -1.854
  782    HA   LEU  98           HA       LEU  98  -4.846   5.700  -1.249
  783    HB2  LEU  98           HB3      LEU  98  -5.668   3.067  -1.905
  784    HB3  LEU  98           HB2      LEU  98  -4.581   3.521  -3.223
  785    HG   LEU  98           HG       LEU  98  -3.778   3.727  -0.242
  786   HD11  LEU  98          HD11      LEU  98  -2.369   1.664  -1.366
  787   HD12  LEU  98          HD12      LEU  98  -3.979   1.419  -2.013
  788   HD13  LEU  98          HD13      LEU  98  -3.666   1.502  -0.266
  789   HD21  LEU  98          HD21      LEU  98  -2.283   3.915  -2.848
  790   HD22  LEU  98          HD22      LEU  98  -1.453   3.731  -1.273
  791   HD23  LEU  98          HD23      LEU  98  -2.512   5.117  -1.625
  792    H    LYS  99           H        LYS  99  -6.660   5.282  -4.171
  793    HA   LYS  99           HA       LYS  99  -4.810   6.078  -6.023
  794    HB2  LYS  99           HB3      LYS  99  -7.741   6.685  -6.204
  795    HB3  LYS  99           HB2      LYS  99  -6.584   6.442  -7.505
  796    HG2  LYS  99           HG3      LYS  99  -7.529   4.344  -5.665
  797    HG3  LYS  99           HG2      LYS  99  -8.066   4.520  -7.337
  798    HD2  LYS  99           HD3      LYS  99  -6.298   2.829  -6.661
  799    HD3  LYS  99           HD2      LYS  99  -5.415   4.389  -7.663
  800    HE2  LYS  99           HE3      LYS  99  -4.196   3.634  -5.939
  801    HE3  LYS  99           HE2      LYS  99  -5.649   3.850  -4.904
  802    HZ1  LYS  99           HZ1      LYS  99  -4.323   1.512  -5.584
  803    HZ2  LYS  99           HZ2      LYS  99  -5.859   1.505  -6.400
  804    HZ3  LYS  99           HZ3      LYS  99  -5.715   1.616  -4.733
  805    H    LYS 100           H        LYS 100  -7.123   7.950  -4.196
  806    HA   LYS 100           HA       LYS 100  -6.300  10.525  -5.296
  807    HB2  LYS 100           HB3      LYS 100  -8.371  10.911  -4.530
  808    HB3  LYS 100           HB2      LYS 100  -8.283   9.502  -3.458
  809    HG2  LYS 100           HG3      LYS 100  -6.952  10.797  -1.793
  810    HG3  LYS 100           HG2      LYS 100  -7.111  12.292  -2.857
  811    HD2  LYS 100           HD3      LYS 100  -9.286  10.758  -1.423
  812    HD3  LYS 100           HD2      LYS 100  -8.796  12.394  -1.144
  813    HE2  LYS 100           HE3      LYS 100  -9.960  11.435  -3.757
  814    HE3  LYS 100           HE2      LYS 100 -11.004  12.029  -2.505
  815    HZ1  LYS 100           HZ1      LYS 100  -9.483  13.513  -4.415
  816    HZ2  LYS 100           HZ2      LYS 100  -8.923  13.894  -2.928
  817    HZ3  LYS 100           HZ3      LYS 100 -10.600  14.101  -3.211
  818    H    ALA 101           H        ALA 101  -5.641   8.568  -2.379
  819    HA   ALA 101           HA       ALA 101  -4.190  10.465  -0.863
  820    HB1  ALA 101           HB1      ALA 101  -3.511   7.566  -0.934
  821    HB2  ALA 101           HB2      ALA 101  -5.060   8.091  -0.271
  822    HB3  ALA 101           HB3      ALA 101  -3.575   8.681   0.523
  823    H    THR 102           H        THR 102  -3.239   8.691  -3.721
  824    HA   THR 102           HA       THR 102  -0.479   9.532  -3.250
  825    HB   THR 102           HB       THR 102  -0.458   7.333  -3.857
  826    HG1  THR 102           HG1      THR 102  -0.946   8.000  -5.580
  827   HG21  THR 102          HG21      THR 102  -2.929   7.861  -5.255
  828   HG22  THR 102          HG22      THR 102  -2.333   6.346  -4.468
  829   HG23  THR 102          HG23      THR 102  -1.798   6.786  -6.149
  830    H    ASN 103           H        ASN 103  -3.428  10.037  -4.886
  831    HA   ASN 103           HA       ASN 103  -2.442  12.479  -6.099
  832    HB2  ASN 103           HB3      ASN 103  -3.819  10.721  -8.072
  833    HB3  ASN 103           HB2      ASN 103  -2.546  11.974  -8.389
  834   HD21  ASN 103          HD21      ASN 103  -3.137   8.686  -7.333
  835   HD22  ASN 103          HD22      ASN 103  -1.604   8.102  -7.626
  836    H    GLU 104           H        GLU 104  -3.894  13.795  -5.318
  837    HA   GLU 104           HA       GLU 104  -6.355  14.306  -6.311
  838    HB2  GLU 104           HB3      GLU 104  -6.447  11.937  -4.446
  839    HB3  GLU 104           HB2      GLU 104  -7.766  13.185  -4.393
  840    HG2  GLU 104           HG3      GLU 104  -7.126  12.369  -7.086
  841    HG3  GLU 104           HG2      GLU 104  -7.699  11.070  -6.125
  842    HHA  HEC 201           HHA      HEC 201   5.229  -5.175   0.501
  843    HHB  HEC 201           HHB      HEC 201  -0.334  -2.435   0.320
  844    HHC  HEC 201           HHC      HEC 201  -2.010  -6.174   5.161
  845    HHD  HEC 201           HHD      HEC 201   4.031  -6.014   6.818
  846   HMA1  HEC 201          HMA1      HEC 201   1.030  -1.113  -1.156
  847   HMA2  HEC 201          HMA2      HEC 201   2.617  -0.301  -0.646
  848   HMA3  HEC 201          HMA3      HEC 201   2.439  -1.573  -1.526
  849   HAA1  HEC 201          HAA1      HEC 201   5.100  -3.014  -1.384
  850   HAA2  HEC 201          HAA2      HEC 201   5.707  -2.419   0.260
  851   HBA1  HEC 201          HBA1      HEC 201   4.249  -0.392  -0.180
  852   HBA2  HEC 201          HBA2      HEC 201   4.004  -0.930  -1.852
  853   HMB1  HEC 201          HMB1      HEC 201  -3.561  -1.980   2.038
  854   HMB2  HEC 201          HMB2      HEC 201  -3.631  -3.179   0.772
  855   HMB3  HEC 201          HMB3      HEC 201  -2.361  -1.956   0.735
  856    HAB  HEC 201           HAB      HEC 201  -3.853  -3.280   4.556
  857   HBB1  HEC 201          HBB1      HEC 201  -5.281  -5.271   2.667
  858   HBB2  HEC 201          HBB2      HEC 201  -4.633  -3.777   1.957
  859   HBB3  HEC 201          HBB3      HEC 201  -5.747  -3.691   3.350
  860   HMC1  HEC 201          HMC1      HEC 201  -0.923  -7.657   8.535
  861   HMC2  HEC 201          HMC2      HEC 201  -1.907  -7.791   6.918
  862   HMC3  HEC 201          HMC3      HEC 201  -0.589  -8.441   7.250
  863    HAC  HEC 201           HAC      HEC 201   2.948  -7.013   8.240
  864   HBC1  HEC 201          HBC1      HEC 201   3.221  -9.404   7.683
  865   HBC2  HEC 201          HBC2      HEC 201   1.569  -9.710   8.255
  866   HBC3  HEC 201          HBC3      HEC 201   2.822  -9.160   9.402
  867   HMD1  HEC 201          HMD1      HEC 201   6.043  -7.171   6.391
  868   HMD2  HEC 201          HMD2      HEC 201   7.154  -5.850   6.046
  869   HMD3  HEC 201          HMD3      HEC 201   7.284  -7.460   5.155
  870   HAD1  HEC 201          HAD1      HEC 201   7.936  -6.403   3.243
  871   HAD2  HEC 201          HAD2      HEC 201   7.618  -5.022   2.268
  872   HBD1  HEC 201          HBD1      HEC 201   7.838  -7.660   1.346
  873   HBD2  HEC 201          HBD2      HEC 201   7.350  -6.274   0.406